Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 2/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8016316 | 0.94 | ADRB2 (0.40) | TYRADRB2CYP3A4MAPTTSHR | |
| SCHEMBL9847101 | 0.87 | ADRB2 (0.42) | ADRB2TSHRHTTHSD17B10PARP1 | |
| SCHEMBL10299142 | 0.80 | ADRB2 (0.44) | ADRB2HTTTDP1PARP1 | |
| SCHEMBL9847103 | 0.76 | TYR (0.43) | TYRKCNH2MEN1TP53CYP3A4 | |
| SCHEMBL5551551 | 0.74 | ALDH1A1 (0.33) | TYRCYP3A4MAPTTSHRHTT | |
| SCHEMBL2330278 | 0.74 | PARP1 (0.47) | ADRB2HTTPARP1 | |
| SCHEMBL27156172 | 0.73 | ADRB2 (0.48) | ADRB2CYP3A4MAPTTSHRHTT | |
| SCHEMBL6753932 | 0.73 | GPR84 (0.42) | KMT2AGPR84 | |
| SCHEMBL6756142 | 0.73 | GPR84 (0.42) | KMT2AGPR84 | |
| SCHEMBL6753984 | 0.73 | GPR84 (0.42) | KMT2AGPR84 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0428260-A2 | Metal surface treatment agents | SANWA LABORATORY LTD. (JP) | 1991-05-22 | — | — | EP | claimed |