Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | ESR1 | P03372 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | PDE5A | O76074 | 5/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | RORC | P51449 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4035275 | 0.91 | ESR1 (0.61) | ALDH1A1ESR1NPSR1CYP1A2CYP3A4 | |
| SCHEMBL4028787 | 0.87 | ESR1 (0.47) | ALDH1A1ESR1NPSR1CYP1A2CYP3A4 | |
| SCHEMBL4025984 | 0.86 | ESR1 (0.61) | ALDH1A1ESR1NPSR1CYP1A2CYP3A4 | |
| SCHEMBL4034694 | 0.82 | ESR1 (0.47) | ALDH1A1ESR1NPSR1CYP1A2CYP3A4 | |
| SCHEMBL5409059 | 0.79 | L3MBTL1 (0.49) | ALDH1A1NPSR1L3MBTL1MAPTSMN1; SMN2 | |
| SCHEMBL3621787 | 0.76 | ALDH1A1 (0.67) | ALDH1A1ESR1NPSR1CYP1A2CYP3A4 | |
| SCHEMBL5400987 | 0.75 | PTGER1 (0.53) | ALDH1A1ESR1NPSR1CYP1A2CYP3A4 | |
| SCHEMBL4028980 | 0.73 | ESR1 (0.57) | ESR1RORC | |
| SCHEMBL7002366 | 0.71 | ESR1 (0.52) | ALDH1A1ESR1NPSR1CYP1A2CYP3A4 | |
| SCHEMBL4025361 | 0.71 | ESR1 (0.62) | ALDH1A1ESR1NPSR1CYP1A2CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7241791-B2 | Substituted 4-(indazol-3-yl)phenols | WYETH (US) | 2007-07-10 | — | — | US | disclosed |