Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.39 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.37 |
| ▸ | GRK6 | P43250 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30103004 | 0.84 | KDM1A (0.41) | KDM1ACYP1A1CYP1B1GRIN1GRIN2B | |
| SCHEMBL24785334 | 0.84 | KDM1A (0.41) | KDM1ACYP1A1CYP1B1GRIN1GRIN2B | |
| SCHEMBL27859257 | 0.75 | CYP1A1 (0.55) | KDM1ACYP1A1CYP1B1LRRK2GRK6 | |
| SCHEMBL30018135 | 0.75 | CYP1A1 (0.55) | KDM1ACYP1A1CYP1B1LRRK2GRK6 | |
| SCHEMBL24785105 | 0.75 | KDM1A (0.47) | KDM1ACYP1A1CYP1B1FGFR1FGFR2 | |
| SCHEMBL30103165 | 0.75 | KDM1A (0.47) | KDM1ACYP1A1CYP1B1FGFR1FGFR2 | |
| SCHEMBL30017725 | 0.74 | SHMT2 (0.41) | GRIN1GRIN2BRAB9A | |
| SCHEMBL1898066 | 0.73 | CYP1A1 (0.44) | KDM1ACYP1A1CYP1B1FGFR1FGFR2 | |
| SCHEMBL15263661 | 0.73 | LMNA (0.39) | CYP1A1CYP1B1NPC1RAB9A | |
| SCHEMBL10165325 | 0.73 | KDM1A (0.45) | KDM1ACYP1A1CYP1B1GRIN1GRIN2B |
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-2022257960-A1 | BICYCLIC COMPOUND FOR THE TREATMENT OF EP2 AND EP4 RECEPTOR-MEDIATED DISEASES | 武汉人福创新药物研发中心有限公司 | 2022-12-15 | — | — | WO | disclosed |