Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | GFER | P55789 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.36 |
| ▸ | PAICS | P22234 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28641562 | 0.84 | KEAP1 (0.54) | KEAP1RAB9AALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL29152983 | 0.81 | KMT2A (0.47) | RAB9ASMN1; SMN2KMT2ANPC1SIGMAR1 | |
| SCHEMBL5801637 | 0.80 | KEAP1 (0.49) | KEAP1RAB9AALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL6638952 | 0.80 | KEAP1 (0.49) | KEAP1RAB9AALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL27568279 | 0.76 | SCN4A (0.58) | HRH3BTK | |
| SCHEMBL1553745 | 0.76 | SCN4A (0.46) | RAB9AALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL3432373 | 0.74 | SIGMAR1 (0.39) | RAB9AALDH1A1SMN1; SMN2GFERMAPT | |
| SCHEMBL19937757 | 0.74 | MAP3K12 (0.54) | PAICSHPGD | |
| SCHEMBL19937663 | 0.73 | MAP3K12 (0.50) | — | |
| SCHEMBL18007582 | 0.73 | SIGMAR1 (0.41) | RAB9AALDH1A1SMN1; SMN2GFERKMT2A |
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-2010045542-A2 | FUSED RING HETEROARYL KINASE INHIBITORS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2010-04-22 | — | — | WO | disclosed |