Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | PITRM1 | Q5JRX3 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14744170 | 1.00 | CYP1A2 (0.47) | CYP1A2POLBTSHRALDH1A1GPR35 | |
| SCHEMBL6665984 | 0.86 | TSHR (0.53) | CYP1A2POLBTSHRALDH1A1GPR35 | |
| SCHEMBL135919 | 0.85 | CA1 (0.45) | CYP1A2POLBTSHRALDH1A1GPR35 | |
| SCHEMBL3379806 | 0.83 | CYP1A2 (0.45) | CYP1A2POLBTSHRALDH1A1GPR35 | |
| SCHEMBL1684411 | 0.83 | ALDH1A1 (0.48) | CYP1A2POLBTSHRALDH1A1CYP3A4 | |
| SCHEMBL30468473 | 0.83 | CYP1A2 (0.45) | CYP1A2POLBTSHRALDH1A1GPR35 | |
| SCHEMBL260788 | 0.82 | CYP1A2 (0.51) | CYP1A2POLBTSHRALDH1A1GPR35 | |
| SCHEMBL29367937 | 0.82 | CYP1A2 (0.51) | CYP1A2POLBTSHRALDH1A1GPR35 | |
| SCHEMBL1464650 | 0.81 | LOXL2 (0.50) | CYP1A2POLBTSHRALDH1A1CYP3A4 | |
| SCHEMBL28151333 | 0.81 | CYP1A2 (0.44) | CYP1A2POLBTSHRALDH1A1GPR35 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4337635-A1 | VINYL ISOCYANIDE COMPOUNDS AS ANTIBACTERIAL AGENTS | University of Leicester (GB) | 2024-03-20 | — | — | EP | disclosed |
| WO-2022238694-A1 | VINYL ISOCYANIDE COMPOUNDS AS ANTIBACTERIAL AGENTS | THE UNIVERSITY OF BATH (GB) | 2022-11-17 | — | — | WO | disclosed |