Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 4/20 | 0.47 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.47 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.44 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.44 |
| ▸ | BRD4 | O60885 | 2/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | RAF1 | P04049 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
| ▸ | POLQ | O75417 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3139471 | 0.87 | FYN (0.52) | FYNTGFBR1ACVR1KIF11POLB | |
| SCHEMBL3138802 | 0.86 | FYN (0.44) | FYNTGFBR1ACVR1KIF11POLB | |
| SCHEMBL3137569 | 0.86 | FYN (0.52) | FYNTGFBR1ACVR1KIF11POLB | |
| SCHEMBL3143232 | 0.84 | POLB (0.57) | FYNTGFBR1ACVR1KIF11POLB | |
| SCHEMBL5359155 | 0.72 | ALDH1A1 (0.53) | FYNPOLBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL1308772 | 0.72 | FYN (0.57) | FYNTGFBR1ACVR1POLB | |
| SCHEMBL13485182 | 0.71 | POLB (0.71) | KIF11POLBHSD17B1HSD17B2BRD4 | |
| SCHEMBL21092440 | 0.71 | KIF11 (0.69) | KIF11HSD17B1HSD17B2BRD4IKBKB | |
| SCHEMBL2040073 | 0.71 | KIF11 (0.61) | KIF11POLBHSD17B1HSD17B2BRD4 | |
| SCHEMBL3100085 | 0.70 | TUBB4A (0.48) | FYNTGFBR1ACVR1HSP90AA1HSP90AB1 |
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-2119719-A1 | THIAZEPINE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2009-11-18 | — | — | EP | disclosed |