Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11586182 | 0.86 | EGFR (0.36) | MTNR1AMTNR1BKMT2AMAPTL3MBTL1 | |
| SCHEMBL11632245 | 0.84 | PDK2 (0.41) | PDK2MTNR1AMTNR1BNQO2KMT2A | |
| SCHEMBL11587643 | 0.83 | PSEN1 (0.38) | PDK2KMT2AMEN1MAPTRAB9A | |
| SCHEMBL11585361 | 0.82 | PDK2 (0.43) | PDK2KMT2AMEN1MAPTNPC1 | |
| SCHEMBL11587639 | 0.81 | HPGD (0.35) | KMT2AMEN1MAPTNPC1RAB9A | |
| SCHEMBL11588154 | 0.81 | APOB (0.37) | KMT2AMEN1MAPTCYP3A4LMNA | |
| SCHEMBL11586278 | 0.79 | HTR2A (0.48) | PDK2MAPTCYP3A4HTR2C | |
| SCHEMBL11587730 | 0.78 | ALDH1A1 (0.37) | MTNR1AMTNR1BKMT2APOLBLMNA | |
| SCHEMBL11586311 | 0.77 | MC4R (0.34) | PDK2MAPTNPC1RAB9APOLB | |
| SCHEMBL11587902 | 0.77 | PDK2 (0.37) | PDK2MTNR1AMTNR1BNQO2KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4070387-A | ANTIARRHYTHMIC AGENTS | MERCK & CO., INC. (US) | 1978-01-24 | — | — | US | disclosed |
| US-4020096-A | ANTIARRYTHMIA | MERCK & CO., INC. (US) | 1977-04-26 | — | — | US | disclosed |
| US-3950423-A | 10,11-Dihydro-10,10,11,11-tetrafluoro-5H-dibenzo[a,d]cycloheptene-5-methylamines | MERCK & CO., INC. (US) | 1976-04-13 | — | — | US | disclosed |