Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.52 |
| ▸ | ACMSD | Q8TDX5 | 3/20 | 0.52 |
| ▸ | HNF4A | P41235 | 2/20 | 0.52 |
| ▸ | DHFR | P00374 | 1/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.50 |
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
| ▸ | IKBKB | O14920 | 1/20 | 0.49 |
| ▸ | GSTA1 | P08263 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | DCLRE1A | Q6PJP8 | 1/20 | 0.42 |
| ▸ | DCLRE1B | Q9H816 | 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 | |
|---|---|---|---|---|
| SCHEMBL14866633 | 0.86 | MCL1 (0.58) | MCL1ACMSDHNF4ADHFRKDM4E | |
| SCHEMBL10024279 | 0.86 | MCL1 (0.63) | MCL1ACMSDHNF4ADHFRIKBKB | |
| SCHEMBL5255978 | 0.86 | MCL1 (0.63) | MCL1ACMSDHNF4ADHFRIKBKB | |
| SCHEMBL1404169 | 0.86 | GSTA1 (0.58) | MAPTSMN1; SMN2MCL1ACMSDHNF4A | |
| SCHEMBL27758953 | 0.85 | MAPT (0.59) | MAPTSMN1; SMN2MCL1ACMSDHNF4A | |
| SCHEMBL2070297 | 0.85 | MCL1 (0.72) | MAPTSMN1; SMN2MCL1ACMSDHNF4A | |
| SCHEMBL7120106 | 0.83 | IKBKB (0.66) | MCL1ACMSDHNF4ADHFRBRD4 | |
| SCHEMBL5951431 | 0.81 | SMN1; SMN2 (0.53) | MAPTSMN1; SMN2MCL1ACMSDHNF4A | |
| SCHEMBL7673881 | 0.81 | ACMSD (0.61) | MAPTSMN1; SMN2MCL1ACMSDHNF4A | |
| SCHEMBL31413664 | 0.81 | SMN1; SMN2 (0.53) | MAPTSMN1; SMN2MCL1ACMSDHNF4A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102245586-A | Thiadiazole-substituted arylamides | HOFFMANN LA ROCHE | 2011-11-16 | — | — | CN | disclosed |
| JP-2003206270-A | METHOD OF PRODUCTION FOR 2-METHYL-5-PHENYLBENZONITRILE | SUMITOMO CHEM CO LTD | 2003-07-22 | — | — | JP | disclosed |