Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | CISD1 | Q9NZ45 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 4/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.42 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA3 | P07451 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.42 |
| ▸ | CA6 | P23280 | 2/20 | 0.42 |
| ▸ | ALDH5A1 | P51649 | 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 | |
|---|---|---|---|---|
| SCHEMBL7716077 | 1.00 | MEN1 (0.50) | MEN1KMT2ACISD1THRBESR1 | |
| SCHEMBL7716030 | 1.00 | MEN1 (0.50) | MEN1KMT2ACISD1THRBESR1 | |
| Hydroquinone SCHEMBL28101386 | 0.76 | CA3 (0.67) | MEN1KMT2ACISD1THRBESR1 | |
| SCHEMBL1514086 | 0.75 | ALDH1A1 (0.38) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL7646254 | 0.75 | ALDH1A1 (0.38) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL3809764 | 0.74 | ALDH5A1 (0.50) | MEN1KMT2ACISD1THRBESR1 | |
| SCHEMBL7171048 | 0.71 | KIF11 (0.44) | MEN1KMT2AALDH1A1KDM4ECA2 | |
| SCHEMBL6247331 | 0.71 | KDM4E (0.53) | ESR1ALDH1A1CYP3A4HPGDKDM4E | |
| SCHEMBL6247325 | 0.71 | KDM4E (0.53) | ESR1ALDH1A1CYP3A4HPGDKDM4E | |
| SCHEMBL12895820 | 0.70 | ALDH5A1 (0.52) | MEN1KMT2ACISD1THRBESR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6376548-B1 | FUNGICIDES; HERBICIDES; INSECTICIDES | ROHM AND HAAS COMPANY | 2002-04-23 | — | — | US | disclosed |
| WO-2001056358-A2 | ENHANCED PROPERTIED PESTICIDES | ROHM AND HAAS COMPANY (US) | 2001-08-09 | — | — | WO | disclosed |