Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.36 |
| ▸ | EGFR | P00533 | 3/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | GALK1 | P51570 | 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 | |
|---|---|---|---|---|
| SCHEMBL9475511 | 0.83 | PRKCZ (0.33) | KDM1A | |
| SCHEMBL8679066 | 0.76 | MAPT (0.44) | KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL11776270 | 0.75 | KDM1A (0.47) | KDM1ASLC6A4MTNR1AIDO1SLC6A2 | |
| SCHEMBL2049798 | 0.71 | TAAR1 (0.36) | KDM1ASLC6A2SLC6A3ALOX12MAPK1 | |
| SCHEMBL6762351 | 0.69 | KDM1A (0.49) | KDM1ASLC6A4MTNR1AIDO1SLC6A2 | |
| SCHEMBL9062578 | 0.69 | ALDH1A1 (0.41) | KDM4EALDH1A1MAPTHPGDMAPK1 | |
| SCHEMBL25440356 | 0.68 | KDM1A (0.47) | KDM1ASLC6A4MTNR1AIDO1SLC6A2 | |
| SCHEMBL27654006 | 0.67 | KDM1A (0.50) | KDM1ASLC6A4MTNR1AIDO1SLC6A2 | |
| SCHEMBL20172556 | 0.67 | SLC6A4 (0.39) | KDM1ASLC6A4SLC6A2SLC6A3DRD2 | |
| SCHEMBL10961959 | 0.67 | KDM1A (0.39) | KDM1ASLC6A4MTNR1AIDO1SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0163238-B1 | SUBSTITUTED AND BRIDGED PYRIDINES USEFUL AS PHARMACEUTICAL AGENTS | MERCK & CO. INC. (US) | 1991-07-24 | — | — | EP | disclosed |
| US-4579851-A | HYPOTENSIVE, ANTIARRHYTHMIA AGENTS | MERCK & CO., INC. (US) | 1986-04-01 | — | — | US | disclosed |
| EP-0163238-A2 | Substituted and bridged pyridines useful as pharmaceutical agents | MERCK & CO. INC. (US) | 1985-12-04 | — | — | EP | disclosed |