Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4768829 | 0.91 | KDM4E (0.44) | ADRB2ADRB1ADRB3SMN1; SMN2KDM4E | |
| SCHEMBL4768822 | 0.81 | SMN1; SMN2 (0.60) | SMN1; SMN2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL4769062 | 0.80 | ADRB2 (0.46) | ADRB2ADRB3SMN1; SMN2KDM4EPOLB | |
| SCHEMBL4773144 | 0.78 | ADORA2A (0.47) | SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD | |
| SCHEMBL4765953 | 0.77 | LMNA (0.52) | SMN1; SMN2ALDH1A1USP2NPC1RAB9A | |
| SCHEMBL4766014 | 0.77 | ADORA1 (0.47) | SMN1; SMN2POLBALDH1A1NPC1RAB9A | |
| SCHEMBL5024997 | 0.76 | ADORA2A (0.53) | CYP1A2CYP3A4ADORA1ADORA2A | |
| SCHEMBL4776165 | 0.75 | CCKBR (0.52) | SMN1; SMN2POLBALDH1A1HSD17B10NPC1 | |
| SCHEMBL4770635 | 0.75 | CYP1A2 (0.52) | ADRB3SMN1; SMN2KDM4EALDH1A1USP2 | |
| SCHEMBL4775234 | 0.74 | LMNA (0.49) | SMN1; SMN2POLBALDH1A1USP2NPC1 |
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 |