Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | GRM5 | P41594 | 3/20 | 0.40 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
| ▸ | KDM4B | O94953 | 1/20 | 0.38 |
| ▸ | KDM5C | P41229 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | MYC | P01106 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23458507 | 0.76 | RAB9A (0.68) | CYP19A1KDM4ERAB9ANPC1GAA | |
| SCHEMBL28580918 | 0.76 | NPC1 (0.40) | KDM4ERAB9ANPC1MYCMAPT | |
| SCHEMBL2760450 | 0.76 | KMT2A (0.51) | KDM4ERAB9ANPC1GAAPOLB | |
| SCHEMBL31227179 | 0.76 | KMT2A (0.51) | KDM4ERAB9ANPC1GAAPOLB | |
| SCHEMBL28573617 | 0.75 | NPC1 (0.39) | KDM4ERAB9ANPC1MYCALDH1A1 | |
| SCHEMBL28566773 | 0.74 | NPC1 (0.41) | KDM4ERAB9ANPC1MYCALDH1A1 | |
| SCHEMBL30443124 | 0.73 | METAP1 (0.49) | CYP19A1KDM4ERAB9ANPC1KDM4A | |
| SCHEMBL28570219 | 0.73 | METAP1 (0.49) | CYP19A1KDM4ERAB9ANPC1KDM4A | |
| SCHEMBL28560848 | 0.73 | RAB9A (0.43) | KDM4ERAB9ANPC1MYCGAA | |
| SCHEMBL4972074 | 0.72 | CYP19A1 (0.46) | CYP19A1KDM4ERAB9ANPC1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-108373476-B | Kinase inhibitor and preparation and application thereof | 成都地奥制药集团有限公司 | 2021-06-01 | — | — | CN | disclosed |