Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 2/20 | 0.34 |
| ▸ | ATR | Q13535 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL106399 | 0.73 | GAA (0.40) | ACACBKMT2ALMNAGAAATR | |
| SCHEMBL30496988 | 0.73 | ATM (0.48) | TSHRHSD17B10LMNAATMCTSK | |
| SCHEMBL5792027 | 0.70 | GAA (0.36) | ACACBGAA | |
| SCHEMBL19064369 | 0.69 | NPC1 (0.51) | ACACBTSHRMAPTKDM4EHPGD | |
| SCHEMBL24387774 | 0.68 | AAK1 (0.46) | KMT2AABCB1TSHRHSD17B10LMNA | |
| SCHEMBL445249 | 0.68 | RAB9A (0.49) | KMT2ALMNAATMKDM4EGAA | |
| SCHEMBL1901957 | 0.67 | CA1 (0.45) | TRPA1KMT2ATSHRHSD17B10CA1 | |
| SCHEMBL2519898 | 0.67 | CYP2D6 (0.54) | KMT2ACA1CA2CA7GAA | |
| SCHEMBL28215407 | 0.66 | CHRNA4 (0.41) | ACACBKMT2ALMNAATMGAA | |
| SCHEMBL28232554 | 0.65 | ALDH1A1 (0.50) | ACACBKMT2ATSHRHSD17B10LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-101784545-B | Pyrimidine derivatives as RAF kinase inhibitors | SUNESIS PHARMACEUTICALS, INC. (US) | 2016-04-20 | — | — | CN | disclosed |