Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 2/20 | 0.37 |
| ▸ | RXRB | P28702 | 2/20 | 0.37 |
| ▸ | RXRG | P48443 | 2/20 | 0.37 |
| ▸ | TACR1 | P25103 | 11/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1971966 | 0.85 | TACR1 (0.45) | RXRARXRBRXRGTACR1ALDH1A1 | |
| SCHEMBL15720332 | 0.76 | HTT (0.35) | RXRARXRBRXRGTACR1ALDH1A1 | |
| SCHEMBL3950720 | 0.75 | MRGPRX4 (0.38) | RXRARXRBRXRGTACR1MRGPRX4 | |
| SCHEMBL23636332 | 0.73 | TP53 (0.48) | ALDH1A1LMNAHTT | |
| SCHEMBL2497436 | 0.72 | EPHX2 (0.44) | ALDH1A1LMNAHTTMTOR | |
| SCHEMBL16776735 | 0.71 | RXRB (0.38) | RXRARXRBRXRG | |
| SCHEMBL15648473 | 0.70 | GPR35 (0.51) | TACR1ALDH1A1LMNAGPR35MTOR | |
| SCHEMBL140938 | 0.70 | IDO1 (0.52) | RXRARXRBRXRGTACR1MTOR | |
| SCHEMBL1025717 | 0.69 | ALOX15 (0.35) | ALDH1A1LMNAHTT | |
| SCHEMBL544452 | 0.68 | ALDH1A1 (0.45) | ALDH1A1 |
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-9133171-B2 | Disubstituted 5-fluoro pyrimidine derivatives containing a sulfoximine group | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-09-15 | — | — | US | disclosed |