Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9213813 | 0.96 | PPARG (0.55) | PPARGCYP1A2CYP2A6RAB9AMAPK1 | |
| SCHEMBL6085554 | 0.90 | TDP1 (0.55) | PPARGRAB9AMAPK1KDM4ETDP1 | |
| SCHEMBL15772637 | 0.87 | PPARG (0.58) | PPARGCYP1A2CYP2A6RAB9AMAPK1 | |
| SCHEMBL15772726 | 0.83 | CYP1A2 (0.55) | PPARGCYP1A2CYP2A6RAB9AMAPK1 | |
| SCHEMBL5701220 | 0.82 | TDP1 (0.68) | PPARGRAB9AMAPK1KDM4ETDP1 | |
| SCHEMBL28985962 | 0.81 | CYP1A2 (0.53) | PPARGCYP1A2CYP2A6RAB9AMAPK1 | |
| SCHEMBL3268079 | 0.81 | CYP1A2 (0.53) | PPARGCYP1A2CYP2A6RAB9AMAPK1 | |
| SCHEMBL7979973 | 0.81 | RAB9A (0.57) | PPARGCYP1A2CYP2A6RAB9AMAPK1 | |
| SCHEMBL7237406 | 0.81 | MAPK1 (0.61) | CYP1A2MAPK1TDP1HRH3MEN1 | |
| SCHEMBL2414300 | 0.80 | MAPT (0.56) | RAB9AMAPK1TDP1NPC1DRD3 |
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-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |