Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28454924 | 0.86 | SLCO1B1 (0.36) | TDP1TRPV1RAB9ANPC1SLC6A9 | |
| SCHEMBL28567015 | 0.81 | SLCO1B1 (0.34) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL18597812 | 0.79 | CYP1A2 (0.44) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1185 | 0.79 | CYP1A2 (0.44) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL28444179 | 0.78 | LIPG (0.40) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL5419 | 0.78 | TDP1 (0.41) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6483 | 0.77 | CYP1A2 (0.43) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1683 | 0.77 | CYP1A2 (0.43) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL28898013 | 0.77 | GABRA5 (0.44) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL19499623 | 0.76 | P2RX7 (0.40) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112771027-B | Lysophosphatidic acid receptor antagonists and process for preparing the same | 武汉朗来科技发展有限公司 | 2024-03-05 | — | — | CN | disclosed |
| WO-2023170025-A1 | AMIDO CYCLOPROPYL DERIVATIVES AS LPA RECEPTOR INHIBITORS | CHIESI FARMACEUTICI S.P.A. (IT) | 2023-09-14 | — | — | WO | disclosed |
| CN-112771027-A | Lysophosphatidic acid receptor antagonists and process for their preparation | 武汉朗来科技发展有限公司 | 2021-05-07 | — | — | CN | disclosed |
| CN-111434655-A | Lysophosphatidic acid receptor antagonists and process for their preparation | 武汉朗来科技发展有限公司 | 2020-07-21 | — | — | CN | disclosed |