Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 4/20 | 0.33 |
| ▸ | HTR1B | P28222 | 4/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PSEN1 | P49768 | 4/20 | 0.32 |
| ▸ | PSEN2 | P49810 | 4/20 | 0.32 |
| ▸ | APH1B | Q8WW43 | 4/20 | 0.32 |
| ▸ | NCSTN | Q92542 | 4/20 | 0.32 |
| ▸ | APH1A | Q96BI3 | 4/20 | 0.32 |
| ▸ | PSENEN | Q9NZ42 | 4/20 | 0.32 |
| ▸ | MAOA | P21397 | 4/20 | 0.32 |
| ▸ | MAOB | P27338 | 4/20 | 0.32 |
| ▸ | GSAP | A4D1B5 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19266090 | 0.85 | DRD2 (0.39) | CYP2A6CYP2A13ALDH1A1TSHRMAOA | |
| SCHEMBL12433446 | 0.84 | CYP2A6 (0.35) | KMT2AHTR1DHTR1BCYP2A6CYP2A13 | |
| SCHEMBL26374344 | 0.78 | DRD2 (0.46) | ALDH1A1 | |
| SCHEMBL30938812 | 0.78 | DRD2 (0.46) | ALDH1A1 | |
| SCHEMBL6958627 | 0.78 | TRPV1 (0.41) | HTR1DHTR1BPSEN1PSEN2APH1B | |
| SCHEMBL6957852 | 0.78 | TRPV1 (0.41) | HTR1DHTR1BPSEN1PSEN2APH1B | |
| SCHEMBL6958077 | 0.78 | DRD2 (0.46) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6953862 | 0.76 | DRD2 (0.45) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6954770 | 0.76 | DRD2 (0.45) | ALDH1A1 | |
| SCHEMBL21096538 | 0.74 | CYP2A6 (0.33) | KMT2ACYP2A6CYP2A13ALDH1A1TSHR |
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-2007034326-A2 | IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS | PFIZER PRODUCTS INC. (US) | 2007-03-29 | — | — | WO | disclosed |