Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.40 |
| ▸ | DRD3 | P35462 | 4/20 | 0.40 |
| ▸ | DRD4 | P21917 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3031915 | 0.84 | OPRM1 (0.45) | ALDH1A1TSHRCYP1A2HTTCHRM2 | |
| SCHEMBL8358191 | 0.82 | ALDH1A1 (0.67) | ALDH1A1TSHRCYP1A2HTTCHRM2 | |
| SCHEMBL8661322 | 0.81 | OPRM1 (0.58) | ALDH1A1TSHRCYP1A2HTTCHRM2 | |
| SCHEMBL24683657 | 0.80 | OPRM1 (0.61) | TSHRCYP1A2HTTCHRM2CHRM1 | |
| SCHEMBL392176 | 0.80 | KCNN4 (0.55) | ALDH1A1TSHRCYP1A2CHRM2CHRM1 | |
| SCHEMBL24684840 | 0.80 | OPRM1 (0.41) | ALDH1A1TSHRHTTOPRM1DRD3 | |
| SCHEMBL4640323 | 0.77 | CHRM2 (0.48) | ALDH1A1TSHRCYP1A2CHRM2CHRM1 | |
| SCHEMBL4813600 | 0.76 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP1A2HTTCYP2C19 | |
| SCHEMBL10769662 | 0.76 | ALDH1A1 (0.46) | ALDH1A1TSHRCHRM2CHRM1CHRM3 | |
| SCHEMBL6384616 | 0.76 | CYP1A2 (0.48) | ALDH1A1TSHRCYP1A2CHRM2CHRM1 |
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-6288063-B1 | ANTIARTHRITIC AGENTS; AUTOIMMUNE, NERVOUS SYSTEM, BRAIN, CARDIOVASCULAR, AND RESPIRATORY SYSTEM DISORDERS | BAYER CORPORATION | 2001-09-11 | — | — | US | disclosed |