Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 2/20 | 0.34 |
| ▸ | BCL6 | P41182 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | MMP12 | P39900 | 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 | |
|---|---|---|---|---|
| SCHEMBL30890339 | 0.76 | LMNA (0.58) | ALDH1A1CYP3A4KDM4EMEN1CYP1A2 | |
| SCHEMBL21723551 | 0.71 | KMT2A (0.46) | ALDH1A1MEN1CYP1A2HPGDKMT2A | |
| SCHEMBL21723552 | 0.71 | KMT2A (0.46) | ALDH1A1MEN1CYP1A2HPGDKMT2A | |
| SCHEMBL6979185 | 0.69 | KDM4E (0.45) | ALDH1A1CYP3A4KDM4EMEN1CYP1A2 | |
| SCHEMBL3267279 | 0.69 | KDM4E (0.57) | ALDH1A1CYP3A4KDM4EMEN1CYP1A2 | |
| SCHEMBL11555960 | 0.69 | ALDH1A1 (0.53) | ALDH1A1CYP3A4KDM4EMEN1CYP1A2 | |
| SCHEMBL3507090 | 0.68 | MEN1 (0.60) | ALDH1A1CYP3A4KDM4EMEN1CYP1A2 | |
| SCHEMBL18942466 | 0.67 | KDM4E (0.35) | ALDH1A1CYP3A4KDM4EMEN1CYP1A2 | |
| SCHEMBL19125373 | 0.67 | ALDH1A1 (0.43) | ALDH1A1KMT2ALMNAHTTSYK | |
| SCHEMBL19124827 | 0.67 | ALDH1A1 (0.43) | ALDH1A1KMT2ALMNAHTTSYK |
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-2563125-A1 | AZAINDOLES AS JANUS KINASE INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2013-03-06 | — | — | EP | disclosed |