Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.71 |
| ▸ | RAB9A | P51151 | 3/20 | 0.71 |
| ▸ | NPC1 | O15118 | 2/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.63 |
| ▸ | HPGD | P15428 | 1/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | SHBG | P04278 | 1/20 | 0.50 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL480668 | 0.90 | CYP3A4 (0.61) | MAPTRAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL6550540 | 0.88 | SHBG (0.61) | MAPTRAB9ANPC1ALDH1A1HPGD | |
| Ethylene Glycol SCHEMBL1832016 | 0.83 | CYP3A4 (0.69) | MAPTRAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL10435899 | 0.83 | CYP3A4 (0.54) | MAPTRAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL15054796 | 0.83 | MAPT (1.00) | MAPTRAB9ANPC1ALDH1A1HPGD | |
| Oxirane SCHEMBL28748999 | 0.81 | CYP3A4 (0.53) | MAPTRAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL15054998 | 0.81 | KDM4E (0.71) | MAPTRAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL31247993 | 0.81 | KDM4E (0.71) | MAPTRAB9ANPC1ALDH1A1HPGD | |
| 1,4-Butanediol SCHEMBL1592411 | 0.80 | CYP3A4 (0.65) | MAPTRAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL20883388 | 0.79 | MAPT (0.47) | MAPTRAB9ANPC1ALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1054881-B1 | NOVEL SULFONAMIDE SUBSTITUTED CHROMAN DERIVATIVES USEFUL AS BETA-3 ADRENORECEPTOR AGONISTS | BAYER CORP (US) | 2008-07-30 | — | — | EP | disclosed |
| US-6051586-A | HYPOGLYCEMIC AGENTS; ANTIDIABETIC AGENTS | BAYER CORPORATION (US) | 2000-04-18 | — | — | US | disclosed |
| US-3997519-A | Method of producing quaternary pyridinium compounds | GAF CORPORATION (US) | 1976-12-14 | — | — | US | disclosed |