Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 8/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | LDHA | P00338 | 1/20 | 0.31 |
| ▸ | LDHB | P07195 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.30 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.30 |
| ▸ | FEN1 | P39748 | 1/20 | 0.30 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.30 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.30 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.30 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.30 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11475671 | 0.74 | PIN1 (0.50) | PIN1CYP1A2MAPK1CASP1CYP2C19 | |
| SCHEMBL28169947 | 0.74 | PIN1 (0.50) | PIN1CYP1A2MAPK1CASP1CYP2C19 | |
| SCHEMBL2811194 | 0.73 | PIN1 (0.48) | PIN1CYP1A2MAPK1CASP1CYP2C19 | |
| SCHEMBL2522013 | 0.73 | PIN1 (0.48) | PIN1CYP1A2MAPK1CASP1CYP2C19 | |
| SCHEMBL213561 | 0.73 | PIN1 (0.48) | PIN1CYP1A2MAPK1CASP1CYP2C19 | |
| SCHEMBL9280474 | 0.73 | PIN1 (0.48) | PIN1CYP1A2MAPK1CASP1CYP2C19 | |
| SCHEMBL11491730 | 0.71 | PIN1 (0.47) | PIN1CYP1A2MAPK1CASP1CYP2C19 | |
| SCHEMBL10404550 | 0.69 | PIN1 (0.41) | PIN1CYP1A2MAPK1CASP1CYP2C19 | |
| SCHEMBL11008167 | 0.68 | PIN1 (0.44) | PIN1CYP1A2MAPK1CASP1CYP2C19 | |
| SCHEMBL353311 | 0.68 | PIN1 (0.44) | PIN1CYP1A2MAPK1CASP1CYP2C19 |
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-4914206-A | ANTIBIOTICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-04-03 | — | — | US | disclosed |
| EP-0226896-A2 | Lankacidin derivatives and production thereof | Takeda Chemical Industries, Ltd. (JP) | 1987-07-01 | — | — | EP | disclosed |