Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | CCND1 | P24385 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7345842 | 0.94 | ALDH1A1 (0.38) | ALDH1A1LMNAMAPTHTTHPGD | |
| SCHEMBL7778674 | 0.92 | KMT2A (0.42) | ALDH1A1LMNAMAPTHTTHPGD | |
| SCHEMBL7338326 | 0.82 | KMT2A (0.42) | ALDH1A1LMNAMAPTHTTHPGD | |
| SCHEMBL7780700 | 0.81 | AVPR2 (0.48) | ALDH1A1LMNAMAPTHTTHPGD | |
| SCHEMBL8637529 | 0.80 | AVPR2 (0.40) | ALDH1A1HPGDMEN1KMT2AACHE | |
| SCHEMBL7340129 | 0.78 | KMT2A (0.36) | ALDH1A1LMNAMAPTHTTHPGD | |
| SCHEMBL7339161 | 0.78 | CDK1 (0.35) | LMNAMAPTHTTACHECDK1 | |
| SCHEMBL7340123 | 0.78 | KMT2A (0.36) | ALDH1A1LMNAMAPTHTTHPGD | |
| SCHEMBL7340721 | 0.76 | AVPR2 (0.39) | ALDH1A1LMNAMAPTHTTHPGD | |
| SCHEMBL7345832 | 0.76 | AVPR2 (0.46) | ALDH1A1LMNAMEN1KMT2AAVPR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0832061-B1 | BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO (JP) | 2001-09-05 | — | — | EP | disclosed |