Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | RAB9A | P51151 | 5/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.51 |
| ▸ | TSHR | P16473 | 4/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL2240945 | 0.83 | GBA1 (0.54) | NPC1RAB9ASMN1; SMN2TSHRTP53 | |
| SCHEMBL2238098 | 0.83 | PTGDR (0.53) | NPC1RAB9ASMN1; SMN2TSHRTP53 | |
| SCHEMBL2237295 | 0.82 | CYP2A6 (0.45) | NPC1RAB9ASMN1; SMN2TSHRTP53 | |
| SCHEMBL4765953 | 0.82 | LMNA (0.52) | NPC1RAB9ASMN1; SMN2TSHRTP53 | |
| SCHEMBL2237320 | 0.81 | HIF1A (0.47) | NPC1RAB9ASMN1; SMN2TSHRTP53 | |
| SCHEMBL2243750 | 0.80 | PTGDR (0.41) | NPC1RAB9ASMN1; SMN2TSHRTP53 | |
| SCHEMBL2242475 | 0.80 | PTGDR (0.54) | NPC1RAB9ASMN1; SMN2TSHRTP53 | |
| SCHEMBL2238047 | 0.79 | KDM6B (0.41) | NPC1RAB9ASMN1; SMN2TSHRTP53 | |
| SCHEMBL4775234 | 0.79 | LMNA (0.49) | NPC1RAB9ASMN1; SMN2TSHRTP53 | |
| SCHEMBL2243751 | 0.78 | PTGDR (0.44) | NPC1RAB9ASMN1; SMN2TSHRTP53 |
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-1878733-A1 | Pyrimidine derivatives as ALK-5 inhibitors | Novartis AG (CH) | 2008-01-16 | — | — | EP | disclosed |