Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | GABRP | O00591 | 1/20 | 0.58 |
| ▸ | GABRD | O14764 | 1/20 | 0.58 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.58 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.58 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.58 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.58 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.58 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.58 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.58 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.58 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.58 |
| ▸ | GABRE | P78334 | 1/20 | 0.58 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.58 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.58 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.58 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.58 |
| ▸ | HTR1D | P28221 | 11/20 | 0.54 |
| ▸ | HTR1B | P28222 | 11/20 | 0.54 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8574883 | 1.00 | KDM4E (0.60) | KDM4EATMGABRPGABRDGABRA1 | |
| SCHEMBL8572226 | 1.00 | KDM4E (0.60) | KDM4EATMGABRPGABRDGABRA1 | |
| SCHEMBL7480581 | 0.93 | HTR1D (0.63) | HTR1DHTR1BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7824785 | 0.90 | HTR1D (0.54) | KDM4EATMGABRPGABRDGABRA1 | |
| SCHEMBL8783956 | 0.86 | KDM4E (0.55) | KDM4EATMGABRPGABRDGABRA1 | |
| SCHEMBL8784524 | 0.82 | KDM4E (0.58) | KDM4EATMGABRPGABRDGABRA1 | |
| SCHEMBL8446454 | 0.80 | OPRM1 (0.62) | HTR1DHTR1B | |
| SCHEMBL8508491 | 0.80 | KDM4E (0.68) | KDM4EATMGABRPGABRDGABRA1 | |
| SCHEMBL8784592 | 0.79 | HTR1D (0.58) | HTR1DHTR1BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8784108 | 0.79 | GABRP (0.58) | KDM4EATMGABRPGABRDGABRA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0925302-B1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO INC (US) | 2002-11-20 | — | — | EP | claimed |
| CN-1228094-A | Palladium catalyzed indolization | MERCK & CO INC (US) | 1999-09-08 | — | — | CN | claimed |
| EP-0925302-A1 | PALLADIUM CATALYZED INDOLIZATION | Merck & Co., Inc. (US) | 1999-06-30 | — | — | EP | claimed |
| EP-0581538-B1 | 4-Substituted 1,2,4-triazole derivatives | MERCK SHARP & DOHME (GB) | 1999-03-03 | — | — | EP | claimed |
| US-5808064-A | HYDROSILATION OF AN INDOLE AS CHEMICAL INTERMEDIATE | MERCK & CO., INC. (US) | 1998-09-15 | — | — | US | claimed |
| WO-1998006725-A1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO., INC. (US) | 1998-02-19 | — | — | WO | claimed |
| CN-1037101-C | 4-substituted 1,2,4-triazole derivatives | MERCK SHARP & DOHME (GB) | 1998-01-21 | — | — | CN | claimed |
| WO-1994003446-A1 | 4-SUBSTITUTED 1,2,4-TRIAZOLE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1994-02-17 | — | — | WO | claimed |
| EP-0581538-A1 | 4-Substituted 1,2,4-triazole derivatives | MERCK SHARP & DOHME LTD. (GB) | 1994-02-02 | — | — | EP | claimed |
| JP-6184139-A | — | — | None | — | — | JP | disclosed |
| EP-0925302-B1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO INC (US) | 2002-11-20 | — | — | EP | disclosed |
| CN-1084751-C | Palladium catalyzed indolization | MERCK & CO INC (US) | 2002-05-15 | — | — | CN | disclosed |
| CN-1228094-A | Palladium catalyzed indolization | MERCK & CO INC (US) | 1999-09-08 | — | — | CN | disclosed |
| EP-0925302-A1 | PALLADIUM CATALYZED INDOLIZATION | Merck & Co., Inc. (US) | 1999-06-30 | — | — | EP | disclosed |
| WO-1998006725-A1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO., INC. (US) | 1998-02-19 | — | — | WO | disclosed |
| CN-1037101-C | 4-substituted 1,2,4-triazole derivatives | MERCK SHARP & DOHME (GB) | 1998-01-21 | — | — | CN | disclosed |
| US-5554629-A | HEADACHES | MERCK, SHARP & DOHME LTD. (GB) | 1996-09-10 | — | — | US | disclosed |
| JP-H06184139-A | 4-SUBSTITUTED 1,2,4-TRIAZOLE DERIVATIVE | MERCK SHARP & DOHME LTD | 1994-07-05 | — | — | JP | disclosed |
| WO-1994003446-A1 | 4-SUBSTITUTED 1,2,4-TRIAZOLE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1994-02-17 | — | — | WO | disclosed |
| EP-0581538-A1 | 4-Substituted 1,2,4-triazole derivatives | MERCK SHARP & DOHME LTD. (GB) | 1994-02-02 | — | — | EP | disclosed |