Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R8 | Q9NYW2 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | NAMPT | P43490 | 7/20 | 0.53 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.48 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.48 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.46 |
| ▸ | FLT1 | P17948 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15317732 | 0.89 | FLT1 (0.59) | TAS2R8NPC1RAB9ANAMPTFLT1 | |
| SCHEMBL4285528 | 0.80 | NAMPT (0.65) | TAS2R8RAB9ASMN1; SMN2NAMPTHCRTR1 | |
| SCHEMBL17850388 | 0.76 | RPS6KA2 (0.56) | TAS2R8NPC1RAB9ASMN1; SMN2RPS6KA2 | |
| SCHEMBL10195727 | 0.74 | HRH3 (0.43) | NPC1SMN1; SMN2MEN1ALDH1A1LMNA | |
| SCHEMBL13947140 | 0.73 | KDM4E (0.81) | NPC1RAB9ASMN1; SMN2NAMPTMEN1 | |
| SCHEMBL4283149 | 0.71 | NAMPT (0.66) | TAS2R8RAB9ASMN1; SMN2NAMPTHCRTR1 | |
| SCHEMBL22557285 | 0.71 | HCRTR2 (0.43) | SMN1; SMN2NAMPTHCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL1970224 | 0.70 | GAA (0.81) | NPC1RAB9ASMN1; SMN2NAMPTMEN1 | |
| SCHEMBL13211715 | 0.70 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2NAMPTMEN1 | |
| SCHEMBL1279052 | 0.70 | TAS2R8 (1.00) | TAS2R8 |
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 |