Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 8/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7440399 | 0.98 | CA2 (0.38) | CA2HTR1ADRD2DRD4ADRA1D | |
| SCHEMBL7439952 | 0.92 | CA2 (0.38) | CA2MCHR1FFAR1NPSR1ALDH1A1 | |
| SCHEMBL7437169 | 0.92 | LMNA (0.31) | FFAR1MEN1KMT2ANPSR1 | |
| SCHEMBL7436658 | 0.90 | LMNA (0.39) | DRD2KMT2ANPSR1ALDH1A1 | |
| SCHEMBL7434579 | 0.89 | CA2 (0.35) | CA2NPC1CYP3A4CYP2C19NPSR1 | |
| Hydrochloric Acid SCHEMBL7444380 | 0.89 | LMNA (0.39) | DRD2KMT2ANPSR1ALDH1A1 | |
| SCHEMBL7434853 | 0.89 | MTNR1A (0.40) | ADRA1DADRA1AADRA1BMCHR1NPC1 | |
| Acetic Acid SCHEMBL7435017 | 0.88 | MAPT (0.38) | DRD2MEN1KMT2ANPSR1ALDH1A1 | |
| SCHEMBL7446102 | 0.86 | LMNA (0.39) | ADRA1DADRA1AADRA1BMCHR1NPC1 | |
| SCHEMBL7440558 | 0.86 | — | — |
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-4499100-A | CARDIOUVASCULAR DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1985-02-12 | — | — | US | disclosed |