Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | BCR | P11274 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 2/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL411771 | 0.91 | PTGS1 (0.49) | ALDH1A1SMN1; SMN2PTGS1PTGS2LMNA | |
| SCHEMBL412021 | 0.89 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2PTGS1PTGS2LMNA | |
| SCHEMBL409456 | 0.88 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2ABCB1LMNA | |
| SCHEMBL14619400 | 0.88 | PTGS1 (0.46) | ALDH1A1SMN1; SMN2PTGS1PTGS2LMNA | |
| SCHEMBL412621 | 0.88 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2PTGS1PTGS2CA12 | |
| SCHEMBL411668 | 0.88 | PTGS1 (0.43) | ALDH1A1SMN1; SMN2PTGS1PTGS2LMNA | |
| SCHEMBL410823 | 0.88 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2PTGS1PTGS2LMNA | |
| SCHEMBL410788 | 0.86 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2PTGS1PTGS2ABCB1 | |
| SCHEMBL407745 | 0.86 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2PTGS1PTGS2ABCB1 | |
| SCHEMBL411568 | 0.86 | PTGS1 (0.45) | ALDH1A1SMN1; SMN2PTGS1PTGS2PDGFRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007014198-A1 | 1, 2, 3 -TRIAZOLES INHIBITORS OF TUBULIN POLYMERIZATION FOR THE TREATMENT OF POLIFERATIVE DISORDERS | SYNTA PHARMACEUTICALS CORP. (US) | 2007-02-01 | — | — | WO | disclosed |