Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 6/20 | 0.50 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.43 |
| ▸ | FEN1 | P39748 | 2/20 | 0.43 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11308278 | 1.00 | PIN1 (0.50) | PIN1SLC9A1CYP1A2MAPK1CASP1 | |
| SCHEMBL11560619 | 0.89 | ERCC1 (0.46) | PIN1SLC9A1CYP1A2MAPK1CASP1 | |
| SCHEMBL11565883 | 0.89 | ERCC1 (0.46) | PIN1SLC9A1CYP1A2MAPK1CASP1 | |
| SCHEMBL11564801 | 0.86 | PIN1 (0.64) | PIN1SLC9A1CYP1A2MAPK1CASP1 | |
| SCHEMBL11564804 | 0.86 | PIN1 (0.64) | PIN1SLC9A1CYP1A2MAPK1CASP1 | |
| SCHEMBL11332422 | 0.75 | PIN1 (0.43) | PIN1SLC9A1CYP1A2MAPK1CASP1 | |
| SCHEMBL11638677 | 0.73 | ADORA3 (0.43) | PIN1SLC9A1CYP1A2MAPTNPSR1 | |
| SCHEMBL11638674 | 0.73 | ADORA3 (0.43) | PIN1SLC9A1CYP1A2MAPTNPSR1 | |
| SCHEMBL5918226 | 0.69 | PIN1 (0.78) | PIN1SLC9A1CYP1A2MAPK1CASP1 | |
| SCHEMBL18585937 | 0.68 | GAA (0.49) | PIN1MAPK1MAPTHSD17B10GAA |
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-RE30511-E | ENZYME INHIBITOR, HERBICIDE, CYCLIZATION | AMERICAN CYANAMID COMPANY (US) | 1981-02-10 | — | — | US | disclosed |
| US-4107307-A | ENZYME INHIBITORS, HERBICIDES, RING CLOSURE | AMERICAN CYANAMID COMPANY (US) | 1978-08-15 | — | — | US | disclosed |