Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.50 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.47 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | THRA | P10827 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| SCHEMBL14959983 | 0.93 | SIGMAR1 (0.59) | CYP2A6CYP2A13KCNH2SIGMAR1HRH3 | |
| SCHEMBL7989985 | 0.88 | HRH3 (0.59) | CYP2A6CYP2A13KCNH2ALDH1A1ALDH3A1 | |
| SCHEMBL9670561 | 0.83 | SIGMAR1 (0.64) | KCNH2SIGMAR1LMNAHRH3TAAR1 | |
| SCHEMBL15452989 | 0.81 | ALDH1A1 (0.47) | CYP2A6CYP2A13ALDH1A1ALDH3A1ALDH1A3 | |
| SCHEMBL6811099 | 0.81 | KCNH2 (0.49) | KCNH2SIGMAR1ALDH1A1LMNAHRH3 | |
| Hydrochloric Acid SCHEMBL31031294 | 0.79 | KCNH2 (0.47) | KCNH2SIGMAR1ALDH1A1LMNAHRH3 | |
| Water SCHEMBL31031305 | 0.79 | KCNH2 (0.47) | KCNH2SIGMAR1ALDH1A1LMNAHRH3 | |
| SCHEMBL1825553 | 0.79 | CYP2A6 (0.53) | CYP2A6CYP2A13ALDH1A1ALDH3A1ALDH1A3 | |
| SCHEMBL28324720 | 0.79 | CDK1 (0.48) | CYP2A6SIGMAR1ALDH1A1ALDH3A1ALDH1A3 | |
| SCHEMBL7282399 | 0.79 | SIGMAR1 (0.50) | CYP2A6CYP2A13KCNH2SIGMAR1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6291480-B1 | CONTROL OF COCCIDIOSIS IN POULTRY. | MERCK & CO., INC. | 2001-09-18 | — | — | US | disclosed |