Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 8/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.45 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL242 | 0.70 | CYP19A1 (0.67) | CYP17A1CYP19A1CYP11B1CYP11B2CYP26A1 | |
| SCHEMBL27784193 | 0.67 | CYP17A1 (0.81) | CYP17A1CYP19A1CYP11B1CYP11B2CYP26A1 | |
| SCHEMBL29201351 | 0.67 | CYP11B1 (0.67) | CYP17A1CYP19A1CYP11B1CYP11B2MEN1 | |
| SCHEMBL23234111 | 0.67 | CYP17A1 (0.81) | CYP17A1CYP19A1CYP11B1CYP11B2CYP26A1 | |
| SCHEMBL4043257 | 0.67 | CYP17A1 (0.81) | CYP17A1CYP19A1CYP11B1CYP11B2CYP26A1 | |
| SCHEMBL5297627 | 0.67 | CYP17A1 (0.82) | CYP17A1CYP19A1CYP11B1CYP11B2CYP3A4 | |
| SCHEMBL28346236 | 0.67 | CYP11B1 (0.47) | CYP17A1CYP19A1CYP11B1CYP11B2CYP26A1 | |
| SCHEMBL738495 | 0.66 | CYP19A1 (1.00) | CYP17A1CYP19A1CYP11B1CYP11B2CYP26A1 | |
| SCHEMBL5321586 | 0.66 | CYP19A1 (0.71) | CYP17A1CYP19A1CYP11B1CYP11B2CYP26A1 | |
| SCHEMBL1955810 | 0.66 | TAAR1 (0.46) | ALDH1A1CYP3A4MAPTMAPK1KMT2A |
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-5081131-A | Omega-((hetero)alkyl)benz(cd)-indol-2-amines | AMERICAN CYANAMID COMPANY (US) | 1992-01-14 | — | — | US | disclosed |
| US-4728663-A | HYPOTENSIVE, ANTIARRHYTHMIA | AMERICAN CYANAMID COMPANY (US) | 1988-03-01 | — | — | US | disclosed |
| EP-0230035-A2 | Omega-[(hetero)alkyl]benz[cd]indol-2-amines | AMERICAN CYANAMID COMPANY (US) | 1987-07-29 | — | — | EP | disclosed |