Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.39 |
| ▸ | PTPN7 | P35236 | 2/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 2/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ANPEP | P15144 | 1/20 | 0.37 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 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 | |
|---|---|---|---|---|
| SCHEMBL23978863 | 0.88 | NPC1 (0.41) | RAB9A | |
| SCHEMBL23978714 | 0.88 | CYP19A1 (0.35) | P2RY12 | |
| SCHEMBL23978881 | 0.85 | MEN1 (0.50) | PTPN7DUSP3 | |
| SCHEMBL23978902 | 0.79 | EPHX2 (0.39) | EPHX2P2RY12PTPN7DUSP3CNR1 | |
| SCHEMBL23979115 | 0.74 | TXNRD1 (0.36) | P2RY12 | |
| SCHEMBL23978777 | 0.74 | ROCK2 (0.48) | CNR1 | |
| SCHEMBL23978774 | 0.71 | MEN1 (0.50) | EPHX2SRCKDM5AKDM4CKDM5B | |
| SCHEMBL23978773 | 0.71 | EPHX2 (0.49) | EPHX2P2RY12 | |
| SCHEMBL26507428 | 0.69 | MMP13 (0.40) | — | |
| SCHEMBL24242018 | 0.69 | SRC (0.45) | EPHX2PTPN7DUSP3SRCMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021222789-A1 | INHIBITORS OF ALPHA 2 BETA 1 INTEGRIN AND METHODS OF USE THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2021-11-04 | — | — | WO | disclosed |