Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.50 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | NMT1 | P30419 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8948748 | 0.86 | HTR2C (0.52) | ALDH1A1MAPK1L3MBTL1GLAHTR2C | |
| SCHEMBL15369724 | 0.85 | ALDH1A1 (0.53) | ALDH1A1MAPK1L3MBTL1GLATSHR | |
| SCHEMBL3922320 | 0.84 | NMT1 (0.50) | ALDH1A1MAPK1L3MBTL1GLAHTR2C | |
| SCHEMBL20859045 | 0.84 | ALDH1A1 (0.51) | ALDH1A1MAPK1L3MBTL1GLATSHR | |
| Carbamic Acid SCHEMBL27761521 | 0.83 | CHRNB2 (0.64) | CHRNB2CHRNA4CHRM2CHRM1CHRM3 | |
| Carbamic Acid SCHEMBL27761517 | 0.83 | CHRNB2 (0.64) | CHRNB2CHRNA4CHRM2CHRM1CHRM3 | |
| Carbamic Acid SCHEMBL27761527 | 0.83 | CHRNB2 (0.64) | CHRNB2CHRNA4CHRM2CHRM1CHRM3 | |
| SCHEMBL3161073 | 0.82 | CHRNB2 (0.69) | CHRNB2CHRNA4CHRM2CHRM1CHRM3 | |
| SCHEMBL3493677 | 0.82 | CHRNB2 (0.69) | CHRNB2CHRNA4CHRM2CHRM1CHRM3 | |
| SCHEMBL8316188 | 0.82 | CHRNB2 (0.46) | CHRNB2CHRNA4CHRM2CHRM1CHRM3 |
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-5532255-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-07-02 | — | — | US | disclosed |