Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 9/20 | 0.44 |
| ▸ | NPC1 | O15118 | 8/20 | 0.44 |
| ▸ | HPGD | P15428 | 7/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL7902858 | 1.00 | ALDH1A1 (0.45) | ALDH1A1TSHRRAB9ANPC1HPGD | |
| SCHEMBL21365979 | 1.00 | ALDH1A1 (0.45) | ALDH1A1TSHRRAB9ANPC1HPGD | |
| SCHEMBL130201 | 0.84 | ALDH1A1 (0.47) | ALDH1A1TSHRRAB9ANPC1HPGD | |
| SCHEMBL10239588 | 0.83 | ALDH1A1 (0.49) | ALDH1A1TSHRRAB9ANPC1HPGD | |
| SCHEMBL11940620 | 0.83 | ALDH1A1 (0.49) | ALDH1A1TSHRRAB9ANPC1HPGD | |
| SCHEMBL1144374 | 0.83 | TSHR (0.61) | ALDH1A1TSHRRAB9ANPC1HPGD | |
| SCHEMBL1144375 | 0.83 | TSHR (0.61) | ALDH1A1TSHRRAB9ANPC1HPGD | |
| SCHEMBL563449 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRRAB9ANPC1HPGD | |
| SCHEMBL563447 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRRAB9ANPC1HPGD | |
| SCHEMBL10239590 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRRAB9ANPC1HPGD |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115636782-B | Synthesis method of polyaryl substituted pyridine | 浙江工业大学 | 2024-07-19 | — | — | CN | disclosed |
| CN-115636782-A | Synthetic method of polyaryl substituted pyridine | 浙江工业大学 | 2023-01-24 | — | — | CN | disclosed |
| CN-113444037-A | Green synthesis method of nicotinic acid ester compound based on nonmetal condition | 安阳师范学院 | 2021-09-28 | — | — | CN | disclosed |
| EP-1265903-B1 | THIEPINO[3,2-B]DIHYDROPYRIDINES AND RELATED COMPOSITIONS AND METHODS | ORTHO MCNEIL PHARM INC (US) | 2004-05-12 | — | — | EP | disclosed |
| EP-1265903-A1 | THIEPINO[3,2-B]DIHYDROPYRIDINES AND RELATED COMPOSITIONS AND METHODS | Ortho-Mcneil Pharmaceutical, Inc. (US) | 2002-12-18 | — | — | EP | disclosed |
| US-6420383-B1 | CALCIUM CHANNEL BLOCKERS, HYPERSENSITIVITY, ALLERGY, ASTHMA, BRONCHOSPASM, DYSMENORRHEA, ESOPHAGEAL SPASM, GLAUCOMA, PREMATURE LABOR, URINARY TRACT DISORDERS, GASTROINTESTINAL MOTILITY DISORDERS AND CARDIOVASCULAR DISORDERS. | ORTHO-MCNEIL PHARMACEUTICAL, INC. | 2002-07-16 | — | — | US | disclosed |
| WO-2001070748-A1 | THIEPINO [3,2-b] DIHYDROPYRIDINES AND RELATED COMPOSITIONS AND METHODS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-09-27 | — | — | WO | disclosed |
| US-6258829-B1 | ANTIARRTHMIA AGENTS AND CARDIOVASCULAR DISORDERS | TOA EIYO LTD. (JP) | 2001-07-10 | — | — | US | disclosed |
| EP-0972767-A1 | CYCLOALKA[b]PYRIDINE-3-CARBONYLGUANIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND DRUGS CONTAINING THE SAME | TOA EIYO LTD. (JP) | 2000-01-19 | — | — | EP | disclosed |