Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.39 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.39 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1776018 | 0.76 | TSHR (0.55) | TSHRALDH1A1AOC3CYP2C19NPC1 | |
| SCHEMBL5462064 | 0.76 | TSHR (0.55) | TSHRALDH1A1AOC3CYP2C19NPC1 | |
| SCHEMBL11512451 | 0.75 | TSHR (0.50) | TSHRALDH1A1AOC3CYP2C19NPC1 | |
| Ethylene SCHEMBL11428459 | 0.75 | NR3C2 (0.53) | TSHRALDH1A1AOC3CYP2C19NPC1 | |
| SCHEMBL918512 | 0.74 | NR3C2 (0.56) | TSHRALDH1A1AOC3CYP2C19NPC1 | |
| SCHEMBL43183 | 0.74 | TSHR (0.74) | TSHRALDH1A1AOC3CYP2C19GLA | |
| Hydrochloric Acid SCHEMBL2139953 | 0.72 | TSHR (0.71) | TSHRALDH1A1AOC3CYP2C19GLA | |
| SCHEMBL10842660 | 0.72 | TSHR (0.50) | TSHRALDH1A1AOC3CYP2C19NPC1 | |
| SCHEMBL94987 | 0.72 | TSHR (0.46) | TSHRALDH1A1CYP2C19GLAHTT | |
| SCHEMBL294642 | 0.72 | TSHR (0.64) | TSHRALDH1A1AOC3CYP2C19NPC1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0039903-B1 | 8-SUBSTITUTED PYRROLIZIDINES AND QUATERNARY AMMONIUM SALTS THEREOF | SUNTORY KABUSHIKI KAISHA (JP) | 1986-04-09 | — | — | EP | claimed |
| US-6514988-B1 | A pregnancy controlling agent and a menstrual cycle controlling agent; useful as an agent of spawning promotion in fish | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-02-04 | — | — | US | disclosed |
| CN-1092197-C | Bicyclic thiophene derivatives and use as gonadotropin releasing hormone antagonists | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2002-10-09 | — | — | CN | disclosed |
| US-6187788-B1 | THIENO(2,3-B)(DIHYDRO)PYRIDINE DERIVATIVES; GONADOTROPIN-RELEASING HORMONE ANTAGONISTS; ANTICARCINOGENIC AGENTS; SEXUAL AND UROGENITAL DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-02-13 | — | — | US | disclosed |
| CN-1146206-A | Bicyclic thiophene derivatives and use as gonadotropin releasing hormone antagonists | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1997-03-26 | — | — | CN | disclosed |
| EP-0039903-B1 | 8-SUBSTITUTED PYRROLIZIDINES AND QUATERNARY AMMONIUM SALTS THEREOF | SUNTORY KABUSHIKI KAISHA (JP) | 1986-04-09 | — | — | EP | disclosed |