Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.73 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.73 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10028665 | 0.88 | CHRNB2 (0.85) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 | |
| SCHEMBL6674571 | 0.85 | CHRNB2 (1.00) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 | |
| SCHEMBL30093157 | 0.85 | CHRNB2 (0.79) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 | |
| SCHEMBL31044635 | 0.85 | CHRNB2 (1.00) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 | |
| SCHEMBL21278464 | 0.81 | CHRNB2 (0.73) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 | |
| SCHEMBL6132943 | 0.81 | CHRNB2 (0.73) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 | |
| SCHEMBL3460939 | 0.80 | CHRNB2 (1.00) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 | |
| SCHEMBL30632262 | 0.80 | CHRNB2 (1.00) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 | |
| SCHEMBL16627431 | 0.80 | CHRNB2 (0.77) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 | |
| SCHEMBL12195600 | 0.79 | CHRNB2 (0.69) | CHRNB2CHRNA4CHRNA7KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004058234-A2 | PHARMACEUTICAL COMBINATIONS OF PHTHALAZINE VEGF INHIBITORS AND BENZAMIDE HDAC INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 2004-07-15 | — | — | WO | disclosed |