Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APAF1 | O14727 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TNF | P01375 | 1/20 | 0.42 |
| ▸ | ALPL | P05186 | 2/20 | 0.41 |
| ▸ | ALPG | P10696 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | ALPP | P05187 | 1/20 | 0.41 |
| ▸ | PLAA | Q9Y263 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16612739 | 0.76 | TDP1 (0.54) | APAF1LMNAHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL16612954 | 0.75 | LMNA (0.53) | LMNAHTTTP53KMT2ASMN1; SMN2 | |
| SCHEMBL6446137 | 0.75 | LMNA (0.69) | APAF1LMNAPKMHTTTP53 | |
| SCHEMBL5252741 | 0.71 | LMNA (0.60) | APAF1LMNAHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL14699373 | 0.71 | ADORA2A (0.47) | LMNAKMT2AHDAC1HDAC6 | |
| SCHEMBL16612920 | 0.71 | CDK4 (0.52) | LMNATP53KMT2ASMN1; SMN2TSHR | |
| SCHEMBL22965263 | 0.70 | LMNA (0.65) | APAF1LMNAPKMHTTTP53 | |
| SCHEMBL16612704 | 0.70 | MET (0.41) | LMNATDP1 | |
| SCHEMBL16612684 | 0.70 | HTR2A (0.49) | LMNATP53KMT2AALDH1A1 | |
| SCHEMBL16612601 | 0.70 | DDAH1 (0.50) | PKMHTTKMT2ASMN1; SMN2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2675801-B1 | NOVEL PYRAZOLE AND IMIDAZOLE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2015-04-08 | — | — | EP | claimed |
| EP-2675801-B1 | NOVEL PYRAZOLE AND IMIDAZOLE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2015-04-08 | — | — | EP | disclosed |