Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 6/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.36 |
| ▸ | GABRE | P78334 | 1/20 | 0.36 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.36 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.36 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.36 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.35 |
| ▸ | HTR1B | P28222 | 6/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27308222 | 0.80 | HTR1D (0.42) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL8784287 | 0.80 | HTR1D (0.58) | HTR1BHTR1AHTR1DCYP1A2CYP3A4 | |
| SCHEMBL8783770 | 0.80 | HTR2C (0.52) | NOTUMGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL27343954 | 0.80 | HTR1A (0.50) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL8784524 | 0.78 | KDM4E (0.58) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL8901002 | 0.77 | CYP2D6 (0.43) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL31130003 | 0.73 | NOTUM (0.50) | NOTUMHTR1BHTR1AHTR1D | |
| SCHEMBL27343955 | 0.73 | HTR1A (0.53) | SLC6A4HTR1BHTR1AHTR1D | |
| SCHEMBL27327140 | 0.72 | HTR1A (0.53) | HTR1BHTR1AHTR1D | |
| SCHEMBL27287897 | 0.67 | HTR1D (0.53) | SLC6A4HTR1BHTR1AHTR2AHTR1D |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1038681-C | Triazole derivatives and their use as fungicides | MERCK SHARP DOHME LTD (GB) | 1998-06-10 | — | — | CN | claimed |
| CN-1061654-C | Tetrazole derivatives and process for preparation thereof | MERCK SHARP & DOHME (GB) | 2001-02-07 | — | — | CN | disclosed |
| CN-1060479-C | Preparation method for imidazole derivatives | MERCK SHARP & DOHME (GB) | 2001-01-10 | — | — | CN | disclosed |
| CN-1038681-C | Triazole derivatives and their use as fungicides | MERCK SHARP DOHME LTD (GB) | 1998-06-10 | — | — | CN | disclosed |
| CN-1161967-A | Preparation method for imidazole derivatives | MERCK SHARP & DOHME (GB) | 1997-10-15 | — | — | CN | disclosed |
| CN-1157821-A | Process for preparation of tetrazole derivatives | MERCK SHARP & DOHME (DE) | 1997-08-27 | — | — | CN | disclosed |