Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | AR | P10275 | 1/20 | 0.52 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11371987 | 0.84 | HPGD (0.54) | HPGDCYP3A4TSHRNPSR1ALDH1A1 | |
| SCHEMBL17508259 | 0.82 | TDP1 (0.56) | CYP3A4TSHRALDH1A1ALOX15TDP1 | |
| SCHEMBL30542248 | 0.81 | HPGD (0.60) | HPGDCYP3A4TSHRNPSR1ALDH1A1 | |
| SCHEMBL4826082 | 0.81 | HPGD (0.60) | HPGDCYP3A4TSHRNPSR1ALDH1A1 | |
| SCHEMBL4530935 | 0.81 | CYP3A4 (0.59) | HPGDCYP3A4TSHRNPSR1ALDH1A1 | |
| SCHEMBL17508325 | 0.78 | ALDH1A1 (0.53) | CYP3A4TSHRALDH1A1L3MBTL1ALOX15 | |
| SCHEMBL7093860 | 0.78 | KMT2A (0.61) | CYP3A4TSHRALDH1A1MAPK1MEN1 | |
| SCHEMBL5564793 | 0.78 | KDR (0.40) | CYP3A4ALDH1A1L3MBTL1MEN1MAPT | |
| SCHEMBL3628947 | 0.78 | MEN1 (0.64) | ALDH1A1L3MBTL1MAPK1MEN1MAPT | |
| SCHEMBL14062099 | 0.78 | HPGD (0.56) | HPGDCYP3A4TSHRNPSR1ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1242382-A1 | TRICYCLIC PROTEIN KINASE INHIBITORS | Wyeth (US) | 2002-09-25 | — | — | EP | claimed |
| WO-2001047892-A1 | TRICYCLIC PROTEIN KINASE INHIBITORS | WYETH (US) | 2001-07-05 | — | — | WO | claimed |
| CN-116768798-A | Preparation method of phentolamine mesylate | 江苏联环药业股份有限公司 | 2023-09-19 | — | — | CN | disclosed |
| CN-101463009-B | Method for synthesizing phentolamine mesylate | TIANJIN CENTRAL PHARMACEUTICAL CO LTD | 2010-09-22 | — | — | CN | disclosed |
| CN-101463009-A | Method for synthesizing phentolamine mesylate | TIANJIN CENTRAL PHARMACEUTICAL (CN) | 2009-06-24 | — | — | CN | disclosed |
| US-3965087-A | Trisazo dye containing a diphenylenesulfone structure | SAKAI CHEMICAL INDUSTRY COMPANY LTD. (JA) | 1976-06-22 | — | — | US | disclosed |
| US-3951941-A | POLYAZODYE | SAKAI CHEMICAL INDUSTRY COMPANY, LIMITED (JA) | 1976-04-20 | — | — | US | disclosed |