Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 11/20 | 0.59 |
| ▸ | PARP15 | Q460N3 | 4/20 | 0.59 |
| ▸ | PARP14 | Q460N5 | 2/20 | 0.59 |
| ▸ | PARP4 | Q9UKK3 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.59 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.49 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.47 |
| ▸ | TNKS | O95271 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.47 |
| ▸ | SHBG | P04278 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL21628722 | 0.86 | NPC1 (0.63) | PARP10PARP15PARP14PARP4ALDH1A1 | |
| SCHEMBL480668 | 0.83 | CYP3A4 (0.61) | ALDH1A1KMT2ACYP3A4SMN1; SMN2SHBG | |
| SCHEMBL4671943 | 0.82 | PARP10 (0.70) | PARP10PARP15PARP14PARP4ALDH1A1 | |
| Ethylene Glycol SCHEMBL1832016 | 0.80 | CYP3A4 (0.69) | ALDH1A1KMT2ACYP3A4SMN1; SMN2SHBG | |
| SCHEMBL1836425 | 0.79 | CYP3A4 (0.54) | KMT2ACYP3A4SMN1; SMN2SHBGMDH1 | |
| SCHEMBL4672138 | 0.78 | MAPT (0.71) | ALDH1A1KMT2ACYP3A4SMN1; SMN2SHBG | |
| SCHEMBL28472882 | 0.78 | CYP3A4 (0.61) | ALDH1A1KMT2ACYP3A4SMN1; SMN2SHBG | |
| SCHEMBL3137816 | 0.77 | PARP10 (1.00) | PARP10PARP15PARP14PARP4ALDH1A1 | |
| 1,4-Butanediol SCHEMBL1592411 | 0.77 | CYP3A4 (0.65) | ALDH1A1KMT2ACYP3A4SMN1; SMN2SHBG | |
| SCHEMBL27932707 | 0.77 | SHBG (0.53) | CYP3A4SMN1; SMN2SHBGCA1CA2 |
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 2 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 |