Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 9/20 | 0.47 |
| ▸ | GLS | O94925 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | F2RL3 | Q96RI0 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | F2R | P25116 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6230356 | 0.85 | CYP19A1 (0.59) | CYP19A1MAPTGLSCYP1A2ALDH1A1 | |
| SCHEMBL9486251 | 0.81 | CYP19A1 (0.52) | CYP19A1MAPTGLSCYP1A2ALDH1A1 | |
| SCHEMBL23320466 | 0.80 | CYP19A1 (0.60) | CYP19A1MAPTGLSCYP1A2ALDH1A1 | |
| SCHEMBL6233158 | 0.79 | ALDH1A1 (0.61) | CYP19A1MAPTALDH1A1PKMMEN1 | |
| SCHEMBL3481105 | 0.78 | CYP19A1 (0.61) | CYP19A1MAPTGLSCYP1A2ALDH1A1 | |
| SCHEMBL31036289 | 0.78 | CYP19A1 (0.61) | CYP19A1MAPTGLSCYP1A2ALDH1A1 | |
| SCHEMBL21774736 | 0.76 | CYP19A1 (0.56) | CYP19A1MAPTGLSCYP1A2ALDH1A1 | |
| SCHEMBL8032940 | 0.75 | KCNJ1 (0.48) | CYP19A1MAPTGLSCYP1A2ALDH1A1 | |
| SCHEMBL6637649 | 0.74 | KCNJ1 (0.53) | CYP19A1MAPTGLSCYP1A2ALDH1A1 | |
| SCHEMBL29540854 | 0.74 | MAPT (0.43) | CYP19A1MAPTALDH1A1LMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |