Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACMSD | Q8TDX5 | 3/20 | 0.55 |
| ▸ | HNF4A | P41235 | 2/20 | 0.55 |
| ▸ | DHFR | P00374 | 1/20 | 0.55 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.55 |
| ▸ | IKBKB | O14920 | 1/20 | 0.52 |
| ▸ | GSTA1 | P08263 | 1/20 | 0.50 |
| ▸ | DCLRE1A | Q6PJP8 | 1/20 | 0.49 |
| ▸ | DCLRE1B | Q9H816 | 1/20 | 0.49 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.47 |
| ▸ | FEN1 | P39748 | 1/20 | 0.47 |
| ▸ | ACLY | P53396 | 3/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.46 |
| ▸ | KMO | O15229 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | SMO | Q99835 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL893803 | 0.89 | KDM4E (0.43) | ACMSDHNF4ADHFRMCL1IKBKB | |
| SCHEMBL5063471 | 0.84 | ESR2 (0.55) | ACMSDHNF4ADHFRMCL1IKBKB | |
| SCHEMBL28460186 | 0.83 | KDM4E (0.54) | ACMSDHNF4ADHFRMCL1DCLRE1A | |
| SCHEMBL10911662 | 0.82 | RXRB (0.50) | ACMSDHNF4ADHFRMCL1IKBKB | |
| SCHEMBL4864533 | 0.82 | ALDH1A1 (0.57) | ACMSDHNF4ADHFRMCL1IKBKB | |
| SCHEMBL29129812 | 0.79 | AKR1C2 (0.50) | ACMSDHNF4ADHFRMCL1IKBKB | |
| SCHEMBL68982 | 0.78 | ACMSD (0.70) | ACMSDHNF4ADHFRMCL1IKBKB | |
| SCHEMBL30616786 | 0.78 | ACMSD (0.70) | ACMSDHNF4ADHFRMCL1IKBKB | |
| SCHEMBL24302492 | 0.78 | NR1H4 (0.53) | ACMSDHNF4ADHFRMCL1ACLY | |
| SCHEMBL4352420 | 0.78 | ACMSD (0.46) | ACMSDHNF4ADHFRMCL1IKBKB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0061013-B1 | PROCESS FOR THE PREPARATION OF POLYISOCYANATES | BAYER AG (DE) | 1984-06-27 | — | — | EP | disclosed |
| US-4388246-A | THERMAL SPLITTING OF CARBAMATES | BAYER AKTIENGESELLSCHAFT (DE) | 1983-06-14 | — | — | US | disclosed |
| EP-0061013-A1 | Process for the preparation of polyisocyanates | BAYER AG (DE) | 1982-09-29 | — | — | EP | disclosed |