Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 9/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 9/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 8/20 | 0.43 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6663786 | 0.89 | ADRB2 (0.45) | ADRB2ADRB3ADRB1FGFR1MAPT | |
| SCHEMBL6662634 | 0.83 | ADRB2 (0.60) | ADRB2ADRB3ADRB1 | |
| SCHEMBL6663781 | 0.74 | ADRB3 (0.63) | ADRB2ADRB3ADRB1 | |
| SCHEMBL6663327 | 0.73 | ADRB3 (0.41) | ADRB2ADRB3ADRB1FGFR1MAPT | |
| SCHEMBL6838262 | 0.70 | ADRB2 (0.81) | ADRB2ADRB3ADRB1 | |
| SCHEMBL6667635 | 0.68 | ADRB2 (0.62) | ADRB2ADRB3ADRB1 | |
| SCHEMBL4441119 | 0.68 | ADRB3 (0.70) | ADRB2ADRB3ADRB1 | |
| SCHEMBL6663323 | 0.67 | ADRB3 (0.47) | ADRB2ADRB3ADRB1 | |
| SCHEMBL6662632 | 0.65 | ADRB3 (0.39) | ADRB2ADRB3ADRB1FGFR1MAPT | |
| SCHEMBL31462338 | 0.65 | FGFR1 (0.53) | FGFR1LMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004014850-A2 | SUBSTITUTED AMINOPYRIMIDINES AS NEUROKININ ANTAGONISTS | PREDIX PHARMACEUTICALS HOLDINGS, INC. (US) | 2004-02-19 | — | — | WO | claimed |
| WO-2004014850-A2 | SUBSTITUTED AMINOPYRIMIDINES AS NEUROKININ ANTAGONISTS | PREDIX PHARMACEUTICALS HOLDINGS, INC. (US) | 2004-02-19 | — | — | WO | disclosed |