Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 10/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | LPAR1 | Q92633 | 4/20 | 0.35 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 8/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.33 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ABCB4 | P21439 | 1/20 | 0.33 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.33 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.33 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL12131 | 1.00 | HTR2C (0.36) | HTR2CKDM1AMAOALPAR1LPAR3 | |
| SCHEMBL11148 | 0.82 | LPAR1 (0.54) | KDM1ALPAR1LPAR3MAPTKDM4E | |
| SCHEMBL11549 | 0.78 | LPAR1 (0.46) | LPAR1LPAR3ABCC3ABCC4ABCB11 | |
| SCHEMBL12130 | 0.76 | LPAR1 (0.41) | HTR2CKDM1AMAOALPAR1LPAR3 | |
| SCHEMBL13719 | 0.76 | LPAR1 (0.41) | HTR2CKDM1AMAOALPAR1LPAR3 | |
| SCHEMBL1445 | 0.75 | TSHR (0.44) | LPAR1LPAR3 | |
| SCHEMBL1166 | 0.73 | LPAR1 (0.47) | LPAR1LPAR3MAPTKDM4EABCC3 | |
| SCHEMBL7104 | 0.72 | LPAR1 (0.34) | LPAR1LPAR3TRPV1MAPTKDM4E | |
| SCHEMBL4348 | 0.72 | IGF1R (0.43) | LPAR1LPAR3MAPTKDM4EALDH1A1 | |
| SCHEMBL6761 | 0.71 | LPAR1 (0.38) | LPAR1LPAR3MAPTKDM4EABCC3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2483251-A2 | POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | Amira Pharmaceuticals, Inc. (US) | 2012-08-08 | — | — | EP | disclosed |
| WO-2011041462-A2 | POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | AMIRA PHARMACEUTICALS, INC. (US) | 2011-04-07 | — | — | WO | disclosed |