Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 17/20 | 0.64 |
| ▸ | PDGFRB | P09619 | 6/20 | 0.64 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.64 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.64 |
| ▸ | KDR | P35968 | 1/20 | 0.64 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.64 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.64 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.64 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.64 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.64 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.64 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.64 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.64 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.57 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.57 |
| ▸ | GSK3B | P49841 | 1/20 | 0.57 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.57 |
| ▸ | BCR | P11274 | 14/20 | 0.55 |
| ▸ | ABL2 | P42684 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL4087392 | 0.87 | PDGFRB (0.54) | ABL1PDGFRBHDAC1HDAC3KDR | |
| SCHEMBL4086274 | 0.87 | PDGFRB (0.67) | ABL1PDGFRBHDAC1HDAC3KDR | |
| SCHEMBL4080340 | 0.79 | PDGFRA (0.56) | ABL1PDGFRBHDAC1HDAC3KDR | |
| SCHEMBL4895454 | 0.78 | ABL1 (0.80) | ABL1PDGFRBMAPK8PIK3CGGSK3B | |
| SCHEMBL4087658 | 0.78 | ABL1 (1.00) | ABL1PDGFRBHDAC1HDAC3KDR | |
| Hydrochloric Acid SCHEMBL27711429 | 0.77 | ABL1 (0.79) | ABL1PDGFRBMAPK8PIK3CGGSK3B | |
| SCHEMBL4903328 | 0.77 | MAPK8 (0.81) | ABL1PDGFRBHDAC1MAPK8PIK3CG | |
| Hydrochloric Acid SCHEMBL27708725 | 0.77 | ABL1 (0.77) | ABL1PDGFRBMAPK8PIK3CGGSK3B | |
| SCHEMBL4086310 | 0.73 | HDAC1 (0.84) | ABL1PDGFRBHDAC1HDAC3KDR | |
| SCHEMBL2944431 | 0.72 | CAMKK2 (0.77) | ABL1MAPK8PIK3CGGSK3BCAMKK2 |
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-2060565-A1 | Novel bifunctional compounds which inhibit protein kinases and histone deacetylases | 4SC AG (DE) | 2009-05-20 | — | — | EP | disclosed |