Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | SCN1A | P35498 | 3/20 | 0.45 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.45 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.45 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7348034 | 0.89 | CACNA1C (0.46) | ADORA3CYP2C9CYP1A2KDM4ECYP3A4 | |
| SCHEMBL7349531 | 0.89 | ADORA3 (0.55) | ADORA3CYP2C9CYP1A2KDM4ECYP3A4 | |
| SCHEMBL7347564 | 0.86 | KDM4E (0.55) | ADORA3CYP2C9CYP1A2KDM4ECYP3A4 | |
| SCHEMBL7345505 | 0.86 | POLB (0.55) | ADORA3CYP2C9CYP1A2KDM4ECYP3A4 | |
| SCHEMBL7351371 | 0.85 | CYP1A2 (0.66) | ADORA3CYP2C9CYP1A2KDM4ECYP3A4 | |
| SCHEMBL7342398 | 0.85 | ADORA3 (0.43) | ADORA3CYP2C9CYP1A2KDM4ECYP3A4 | |
| SCHEMBL7350412 | 0.84 | PDE1C (0.65) | ADORA3CYP2C9CYP1A2KDM4ECYP3A4 | |
| SCHEMBL7344608 | 0.84 | KDM4E (0.62) | ADORA3CYP2C9CYP1A2KDM4ECYP3A4 | |
| SCHEMBL10744175 | 0.84 | ALDH1A1 (0.51) | ADORA3KDM4EKMT2AHSD17B10ALDH1A1 | |
| SCHEMBL7349721 | 0.84 | KDM4E (0.62) | ADORA3CYP2C9CYP1A2KDM4ECYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4833150-A | HYPOTENSIVES, ANTIARRHYTHMIA AGENTS | NELSON RESEARCH & DEVELOPMENT CO. (US) | 1989-05-23 | — | — | US | disclosed |
| US-4652573-A | HYPOTENSIVE AGENTS | NELSON RESEARCH & DEVELOPMENT CO. (US) | 1987-03-24 | — | — | US | disclosed |