Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 1/20 | 0.43 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.43 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.43 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 7/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3711134 | 0.90 | LPAR1 (0.42) | IP6K1IP6K3IP6K2PLA2G2ALPAR1 | |
| SCHEMBL2336147 | 0.90 | NR1H4 (0.42) | IP6K1IP6K3IP6K2MRGPRX4NR1H4 | |
| SCHEMBL3706639 | 0.89 | IP6K1 (0.41) | IP6K1IP6K3IP6K2MEN1KMT2A | |
| SCHEMBL3701994 | 0.88 | NR1H4 (0.46) | MRGPRX4NPC1RAB9AHPGDNR1H4 | |
| SCHEMBL3704161 | 0.87 | LPAR1 (0.47) | IP6K1IP6K3IP6K2LPAR1LPAR2 | |
| SCHEMBL3708502 | 0.87 | IP6K1 (0.40) | IP6K1IP6K3IP6K2NPC1RAB9A | |
| SCHEMBL3700510 | 0.87 | LPAR1 (0.36) | IP6K1IP6K3IP6K2NPC1RAB9A | |
| SCHEMBL2335317 | 0.87 | LPAR1 (0.38) | IP6K1IP6K3IP6K2MEN1KMT2A | |
| SCHEMBL1246239 | 0.87 | MAPT (0.39) | IP6K1IP6K3IP6K2PLA2G2ACA1 | |
| SCHEMBL3714244 | 0.86 | KMO (0.41) | SMN1; SMN2HPGDNR1H4KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010077882-A2 | ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS | AMIRA PHARMACEUTICALS, INC. (US) | 2010-07-08 | — | — | WO | claimed |
| WO-2010077882-A2 | ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS | AMIRA PHARMACEUTICALS, INC. (US) | 2010-07-08 | — | — | WO | disclosed |