Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.34 |
| ▸ | BRD4 | O60885 | 3/20 | 0.34 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11670548 | 1.00 | PTPN1 (0.35) | PTPN1ENPP2BRD4PHLPP2TP53 | |
| SCHEMBL11138056 | 0.91 | PTPN1 (0.36) | PTPN1ENPP2BRD4PHLPP2TP53 | |
| SCHEMBL11138059 | 0.91 | PTPN1 (0.36) | PTPN1ENPP2BRD4PHLPP2TP53 | |
| SCHEMBL13744288 | 0.81 | BRD4 (0.43) | PTPN1ENPP2BRD4PHLPP2TP53 | |
| SCHEMBL11672391 | 0.80 | THRB (0.40) | PHLPP2HSD17B10ALDH1A1THRBSENP2 | |
| SCHEMBL11672396 | 0.80 | THRB (0.40) | PHLPP2HSD17B10ALDH1A1THRBSENP2 | |
| SCHEMBL11671592 | 0.78 | THRB (0.32) | HSD17B10THRBSENP2SENP1SUMO2 | |
| SCHEMBL11672358 | 0.78 | CA12 (0.35) | ENPP2BRD4HSD17B10ALDH1A1MAPT | |
| SCHEMBL11671595 | 0.78 | THRB (0.32) | HSD17B10THRBSENP2SENP1SUMO2 | |
| SCHEMBL11672354 | 0.78 | CA12 (0.35) | ENPP2BRD4HSD17B10ALDH1A1MAPT |
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-4029598-A | AZO DYES HAVING A SULFONIC ACID OR CARBOXYL GROUP | E. MERCK A. G. (DT) | 1977-06-14 | — | — | US | claimed |
| US-4029597-A | AZO DYES HAVING A SULFONIC ACID OR CARBOXYL GROUP | E. MERCK A. G. (DT) | 1977-06-14 | — | — | US | claimed |