Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM3 | Q14832 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | PROKR1 | Q8TCW9 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL15317723 | 0.87 | KMT2A (0.54) | GRM3ALDH1A1HPGDKMT2APOLB | |
| SCHEMBL10194851 | 0.83 | GRM3 (0.65) | GRM3ALDH1A1KMT2APOLBSMN1; SMN2 | |
| SCHEMBL4519586 | 0.81 | HPGD (0.56) | GRM3ALDH1A1HPGDKMT2APROKR1 | |
| SCHEMBL10194852 | 0.80 | KMT2A (0.51) | GRM3ALDH1A1KMT2APOLBPROKR1 | |
| SCHEMBL10195711 | 0.80 | KDM2B (0.53) | GRM3ALDH1A1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL10720760 | 0.78 | JAK1 (0.54) | ALDH1A1HPGDKMT2APOLBMEN1 | |
| SCHEMBL10196672 | 0.78 | ALDH1A1 (0.52) | GRM3ALDH1A1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL17888441 | 0.78 | KMT2A (0.54) | GRM3ALDH1A1KMT2APOLBPROKR1 | |
| SCHEMBL25039083 | 0.77 | CYP4F2 (0.44) | GRM3ALDH1A1 | |
| SCHEMBL4434030 | 0.77 | ALDH1A1 (0.43) | GRM3ALDH1A1KMT2APOLBNPC1 |
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-2655357-B1 | INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS | MERCK SERONO SA (CH) | 2016-06-22 | — | — | EP | disclosed |
| WO-2012084704-A1 | INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS | MERCK SERONO S.A. (CH) | 2012-06-28 | — | — | WO | disclosed |