Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 3/20 | 0.34 |
| ▸ | NOS2 | P35228 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8330912 | 0.79 | HRH3 (0.34) | — | |
| SCHEMBL4056256 | 0.79 | NOS1 (0.48) | CYP1A2NOS1NOS2 | |
| SCHEMBL4059958 | 0.74 | NOS1 (0.48) | CYP1A2NOS1NOS2 | |
| SCHEMBL11407095 | 0.74 | CYP1A2 (0.58) | CYP1A2SIGMAR1HPGDKDM4EMEN1 | |
| SCHEMBL2573209 | 0.74 | CYP1A2 (0.58) | CYP1A2SIGMAR1HPGDKDM4EMEN1 | |
| SCHEMBL5617552 | 0.74 | CYP1A2 (0.58) | CYP1A2SIGMAR1HPGDKDM4EMEN1 | |
| SCHEMBL1524766 | 0.74 | CYP1A2 (0.58) | CYP1A2SIGMAR1HPGDKDM4EMEN1 | |
| SCHEMBL60655 | 0.74 | CYP1A2 (0.58) | CYP1A2SIGMAR1HPGDKDM4EMEN1 | |
| SCHEMBL6518887 | 0.74 | CYP1A2 (0.58) | CYP1A2SIGMAR1HPGDKDM4EMEN1 | |
| SCHEMBL6077957 | 0.74 | CYP1A2 (0.58) | CYP1A2SIGMAR1HPGDKDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2170875-A1 | AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS | Wyeth LLC (US) | 2010-04-07 | — | — | EP | disclosed |
| WO-2009012252-A1 | AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS | WYETH (US) | 2009-01-22 | — | — | WO | disclosed |