Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.35 |
| ▸ | BIRC3 | Q13489 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | RARB | P10826 | 3/20 | 0.33 |
| ▸ | RARA | P10276 | 2/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
| ▸ | RARG | P13631 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | KDM6B | O15054 | 3/20 | 0.31 |
| ▸ | KDM4A | O75164 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18862726 | 0.80 | CYP1A2 (0.49) | CYP1A2MALT1BIRC3NPC1RAB9A | |
| SCHEMBL22408846 | 0.80 | CYP1A2 (0.49) | CYP1A2MALT1BIRC3NPC1RAB9A | |
| SCHEMBL17293094 | 0.76 | CYP1A2 (0.51) | CYP1A2MALT1BIRC3NPC1RAB9A | |
| SCHEMBL17293093 | 0.76 | CYP1A2 (0.51) | CYP1A2MALT1BIRC3NPC1RAB9A | |
| SCHEMBL20455857 | 0.73 | CYP1A2 (0.56) | CYP1A2MALT1BIRC3NPC1RAB9A | |
| SCHEMBL22432051 | 0.72 | CYP1A2 (0.45) | CYP1A2MALT1BIRC3NPC1RAB9A | |
| SCHEMBL18787694 | 0.70 | MALT1 (0.45) | MALT1BIRC3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL18862730 | 0.70 | MALT1 (0.45) | MALT1BIRC3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20913179 | 0.70 | MALT1 (0.45) | MALT1BIRC3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL18839707 | 0.69 | MALT1 (0.41) | CYP1A2MALT1BIRC3NPC1RAB9A |
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-3149001-B1 | NOVEL PYRAZOLO PYRIMIDINE DERIVATIVES AND THEIR USE AS MALT1 INHIBITORS | NOVARTIS AG (CH) | 2019-04-24 | — | — | EP | disclosed |