Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 7/20 | 0.47 |
| ▸ | NOX1 | Q9Y5S8 | 3/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | BRD2 | P25440 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17835600 | 0.88 | NOX1 (0.58) | BRD4NOX1ALOX15HTTBRD2 | |
| SCHEMBL17835598 | 0.88 | NOX1 (0.58) | BRD4NOX1ALOX15HTTBRD2 | |
| SCHEMBL8891475 | 0.88 | BRD4 (0.47) | BRD4NOX1BRD2KCNH2BRD3 | |
| SCHEMBL3647221 | 0.81 | MAPT (0.57) | BRD4KDM4EPOLBMAPTCYP1A2 | |
| SCHEMBL8892003 | 0.79 | PDE4D (0.53) | BRD4NOX1 | |
| SCHEMBL2827824 | 0.77 | NOTUM (0.56) | NOTUMALOX15HTTKDM4EMAPT | |
| SCHEMBL17835840 | 0.77 | NOX1 (0.56) | BRD4NOX1HTTBRD2KCNH2 | |
| SCHEMBL31373878 | 0.77 | KMO (0.46) | BRD4NOX1BRD2KCNH2BRD3 | |
| SCHEMBL17835838 | 0.77 | NOX1 (0.56) | BRD4NOX1HTTBRD2KCNH2 | |
| SCHEMBL31721221 | 0.75 | ALOX15 (0.51) | NOTUMALOX15HTTKDM4EPOLB |
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-1997003967-A1 | SUBSTITUTED AROMATIC COMPOUNDS AND THEIR PHARMACEUTICAL USE | RHONE-POULENC RORER LIMITED (GB) | 1997-02-06 | — | — | WO | disclosed |