Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.55 |
| ▸ | QDPR | P09417 | 1/20 | 0.52 |
| ▸ | HTR6 | P50406 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 4/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.46 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.45 |
| ▸ | DRD1 | P21728 | 2/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.43 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5536929 | 0.84 | SLC6A4 (0.61) | SLC6A4QDPRDRD2TGFBR1ACVR1 | |
| SCHEMBL27977286 | 0.80 | QDPR (0.55) | SLC6A4QDPRTGFBR1ACVR1EHMT2 | |
| SCHEMBL5547709 | 0.79 | QDPR (0.54) | SLC6A4QDPRHTR6DRD2DRD4 | |
| SCHEMBL28510095 | 0.78 | SLC6A4 (0.60) | SLC6A4QDPRDRD2TGFBR1ACVR1 | |
| SCHEMBL28517116 | 0.77 | SLC6A4 (0.55) | SLC6A4HTR6DRD2DRD4CHRM1 | |
| SCHEMBL10917066 | 0.77 | SLC6A4 (0.58) | SLC6A4QDPRHTR6DRD2DRD4 | |
| SCHEMBL4825697 | 0.76 | CNR1 (0.54) | QDPRHTR6 | |
| SCHEMBL31223021 | 0.75 | QDPR (0.44) | SLC6A4QDPRDRD2TGFBR1ACVR1 | |
| SCHEMBL7033282 | 0.74 | QDPR (0.56) | SLC6A4QDPRTGFBR1ACVR1EHMT2 | |
| Hydrochloric Acid SCHEMBL7030177 | 0.74 | QDPR (0.56) | SLC6A4QDPRTGFBR1ACVR1EHMT2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112243439-A | Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-01-19 | — | — | CN | disclosed |