Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F13A1 | P00488 | 1/20 | 0.49 |
| ▸ | TGM2 | P21980 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.37 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.37 |
| ▸ | KIT | P10721 | 4/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 4/20 | 0.36 |
| ▸ | KDR | P35968 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19417979 | 1.00 | F13A1 (0.49) | F13A1TGM2CYP19A1CYP3A4CYP1A1 | |
| SCHEMBL19418153 | 0.83 | F13A1 (0.64) | F13A1TGM2CYP3A4MAPTMKNK2 | |
| SCHEMBL10150026 | 0.82 | F13A1 (0.57) | F13A1TGM2CYP19A1CYP3A4CYP1A1 | |
| SCHEMBL19418453 | 0.82 | F13A1 (0.57) | F13A1TGM2CYP19A1CYP3A4CYP1A1 | |
| SCHEMBL10150031 | 0.82 | F13A1 (0.57) | F13A1TGM2CYP19A1CYP3A4CYP1A1 | |
| SCHEMBL10150126 | 0.82 | F13A1 (0.55) | F13A1TGM2CYP19A1CYP3A4CYP1A1 | |
| SCHEMBL10150131 | 0.82 | F13A1 (0.55) | F13A1TGM2CYP19A1CYP3A4CYP1A1 | |
| SCHEMBL10150865 | 0.81 | F13A1 (0.56) | F13A1TGM2CYP19A1CYP3A4CYP1A1 | |
| SCHEMBL10150870 | 0.81 | F13A1 (0.56) | F13A1TGM2CYP19A1CYP3A4CYP1A1 | |
| SCHEMBL19418053 | 0.73 | F13A1 (0.44) | F13A1TGM2CYP19A1CYP3A4CYP1A1 |
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-2136799-B1 | MACROCYCLIC COMPOUNDS USEFUL AS INHIBITORS OF KINASES AND HSP90 | UNIV STRASBOURG (FR) | 2017-10-04 | — | — | EP | disclosed |