Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.64 |
| ▸ | NPC1 | O15118 | 3/20 | 0.62 |
| ▸ | HPGD | P15428 | 3/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.60 |
| ▸ | PLAAT3 | P53816 | 2/20 | 0.58 |
| ▸ | PLAAT5 | Q96KN8 | 2/20 | 0.58 |
| ▸ | PLAAT2 | Q9NWW9 | 2/20 | 0.58 |
| ▸ | PLAAT4 | Q9UL19 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | CNR1 | P21554 | 1/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL2298030 | 0.89 | PLAAT5 (0.66) | NPC1RAB9APLAAT3PLAAT5PLAAT2 | |
| SCHEMBL13860790 | 0.85 | L3MBTL1 (0.68) | L3MBTL1NPC1HPGDRAB9AGAA | |
| SCHEMBL1953254 | 0.85 | L3MBTL1 (0.68) | L3MBTL1NPC1HPGDRAB9AGAA | |
| Hydrochloric Acid SCHEMBL27759637 | 0.84 | L3MBTL1 (0.66) | L3MBTL1NPC1HPGDRAB9AGAA | |
| SCHEMBL164622 | 0.81 | L3MBTL1 (0.72) | L3MBTL1NPC1HPGDRAB9AGAA | |
| SCHEMBL15093821 | 0.81 | EPHX2 (0.86) | L3MBTL1NPC1HPGDRAB9AGAA | |
| SCHEMBL15224134 | 0.81 | L3MBTL1 (0.72) | L3MBTL1NPC1HPGDRAB9AGAA | |
| SCHEMBL1955322 | 0.80 | TRPV1 (0.65) | L3MBTL1NPC1HPGDRAB9AGAA | |
| SCHEMBL5932867 | 0.79 | L3MBTL1 (0.70) | L3MBTL1NPC1HPGDRAB9AGAA | |
| SCHEMBL10949637 | 0.79 | L3MBTL1 (0.60) | L3MBTL1NPC1HPGDRAB9AGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117645579-A | Aza-fused ring compounds as RIPK1 inhibitors and uses thereof | 科辉智药生物科技(深圳)有限公司 | 2024-03-05 | — | — | CN | disclosed |
| WO-2020149129-A1 | METHOD FOR PRODUCING ASYMMETRIC COMPOUND | 株式会社カネカ | 2020-07-23 | — | — | WO | disclosed |
| EP-2210607-B1 | N-[3-fluoro-4-({6-(methyloxy)-7-[(3-morpholin-4-ylpropyl)oxy]quinolin-4-yl}oxy)phenyl]-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide for the treatment of cancer | EXELIXIS INC (US) | 2011-08-17 | — | — | EP | disclosed |