Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | LDHA | P00338 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.35 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.35 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24785105 | 1.00 | KDM1A (0.47) | KDM1ANPC1RAB9ACYP1A1CYP1B1 | |
| SCHEMBL30103132 | 0.86 | KDM1A (0.47) | KDM1ANPC1RAB9ACYP1A1CYP1B1 | |
| SCHEMBL24785377 | 0.86 | KDM1A (0.47) | KDM1ANPC1RAB9ACYP1A1CYP1B1 | |
| SCHEMBL24784622 | 0.75 | P2RX7 (0.40) | KDM1ANPC1RAB9ALDHAFGFR1 | |
| SCHEMBL24785335 | 0.75 | KDM1A (0.41) | KDM1ANPC1RAB9ACYP1A1CYP1B1 | |
| SCHEMBL30103062 | 0.73 | KDM1A (0.49) | KDM1AGRM5KDM4ETDP1FYN | |
| SCHEMBL30103128 | 0.73 | ALDH1A1 (0.47) | NPC1RAB9ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL24785826 | 0.73 | KDM1A (0.49) | KDM1AGRM5KDM4ETDP1FYN | |
| SCHEMBL24785814 | 0.73 | ALDH1A1 (0.47) | NPC1RAB9ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL30915012 | 0.73 | HPGDS (0.46) | KDM4EMAPTFYN |
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-115448913-A | Bicyclic compounds for the treatment of EP2, EP4 receptor mediated diseases | 武汉人福创新药物研发中心有限公司 | 2022-12-09 | — | — | CN | disclosed |