Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.44 |
| ▸ | DRD4 | P21917 | 2/20 | 0.44 |
| ▸ | VNN1 | O95497 | 1/20 | 0.43 |
| ▸ | AGXT | P21549 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | KIT | P10721 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.41 |
| ▸ | QPCT | Q16769 | 2/20 | 0.41 |
| ▸ | CETP | P11597 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30245117 | 1.00 | DRD2 (0.44) | DRD2DRD4VNN1AGXTUSP2 | |
| SCHEMBL25252686 | 0.94 | AGXT (0.50) | DRD2DRD4VNN1AGXTMAPT | |
| SCHEMBL30244840 | 0.94 | AGXT (0.50) | DRD2DRD4VNN1AGXTMAPT | |
| SCHEMBL30245733 | 0.94 | CETP (0.44) | DRD2DRD4VNN1AGXTHTR6 | |
| SCHEMBL25291766 | 0.94 | CETP (0.44) | DRD2DRD4VNN1AGXTHTR6 | |
| SCHEMBL25251322 | 0.93 | CNR1 (0.42) | DRD2DRD4MAPTMAPK1KMT2A | |
| SCHEMBL30245453 | 0.93 | CNR1 (0.42) | DRD2DRD4MAPTMAPK1KMT2A | |
| SCHEMBL30245395 | 0.91 | MAPT (0.46) | DRD2DRD4AGXTMAPTMAPK1 | |
| SCHEMBL25298289 | 0.90 | DRD2 (0.44) | DRD2DRD4MAPTABCB1POLB | |
| SCHEMBL25262893 | 0.90 | KIT (0.43) | DRD2DRD4VNN1USP2MAPT |
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-2023018472-A9 | AMINOARYL-INTEGRIN AGONISTS COMPOUNDS | TEXAS HEART INSTITUTE (US) | 2023-07-13 | — | — | WO | disclosed |