Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | TLR2 | O60603 | 1/20 | 0.44 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21611427 | 0.86 | SLC6A3 (0.57) | SLC6A3SLC6A4SLC6A2ATM | |
| SCHEMBL21611425 | 0.86 | SLC6A3 (0.57) | SLC6A3SLC6A4SLC6A2ATM | |
| SCHEMBL22492077 | 0.86 | SLC6A3 (0.53) | SLC6A3SLC6A4SLC6A2ATM | |
| SCHEMBL15196794 | 0.86 | SLC6A3 (0.53) | SLC6A3SLC6A4SLC6A2ATM | |
| SCHEMBL21611429 | 0.86 | SLC6A3 (0.57) | SLC6A3SLC6A4SLC6A2ATM | |
| SCHEMBL22492074 | 0.86 | SLC6A3 (0.53) | SLC6A3SLC6A4SLC6A2ATM | |
| SCHEMBL754814 | 0.83 | SLC6A3 (0.52) | SLC6A3SLC6A4SLC6A2ATMPOLB | |
| SCHEMBL10267974 | 0.83 | SLC6A3 (0.52) | SLC6A3SLC6A4SLC6A2ATMPOLB | |
| SCHEMBL754813 | 0.83 | SLC6A3 (0.52) | SLC6A3SLC6A4SLC6A2ATMPOLB | |
| SCHEMBL10292910 | 0.83 | SLC6A3 (0.52) | SLC6A3SLC6A4SLC6A2ATMPOLB |
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-6500844-B1 | PIPERIDINYL-1-METHYLCYCLOPENTANES AND STEREOISOMERS, USED AS ANTIINFLAMMATORY AND PROPHYLACTIC AGENTS AGAINST ALLERGIC RHINITIS, DERMATITIS, VISION DEFECTS, ASTHMA, ATHRITIS AND FOR PREVENTION OR DELAY OF AQUIRED IMMUNE DIFICIENCY SYNDROME | MERCK & CO., INC. | 2002-12-31 | — | — | US | disclosed |