Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | FAAH | O00519 | 9/20 | 0.54 |
| ▸ | CES1 | P23141 | 6/20 | 0.54 |
| ▸ | CES2 | O00748 | 5/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Nonanol SCHEMBL271357 | 1.00 | LMNA (0.59) | LMNAHSD17B10MEN1KMT2AALDH1A1 | |
| 1-Heptanol SCHEMBL22557209 | 1.00 | LMNA (0.59) | LMNAHSD17B10MEN1KMT2AALDH1A1 | |
| Octanol SCHEMBL374162 | 1.00 | LMNA (0.59) | LMNAHSD17B10MEN1KMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL28259283 | 0.93 | ALDH1A1 (0.52) | LMNAHSD17B10MEN1KMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5402982 | 0.91 | ALDH1A1 (0.55) | LMNAHSD17B10MEN1KMT2AALDH1A1 | |
| Heptane SCHEMBL1776021 | 0.91 | FAAH (0.58) | HSD17B10MEN1KMT2AALDH1A1TSHR | |
| Trifluoroacetic Acid SCHEMBL28259282 | 0.91 | FAAH (0.54) | HSD17B10MEN1KMT2ASMN1; SMN2FAAH | |
| Heptane SCHEMBL3935940 | 0.91 | FAAH (0.62) | HSD17B10MEN1KMT2AALDH1A1TSHR | |
| Nonane SCHEMBL4255344 | 0.91 | FAAH (0.62) | HSD17B10MEN1KMT2AALDH1A1TSHR | |
| Hexadecane SCHEMBL4765353 | 0.91 | FAAH (0.62) | HSD17B10MEN1KMT2AALDH1A1TSHR |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107688069-A | The detection method of the dimethanol of (1R, 2R) hexamethylene 1,2 | 安徽灵药业有限公司 | 2018-02-13 | — | — | CN | claimed |
| EP-3416963-A1 | HISTONE METHYLTRANSFERASE INHIBITORS | Global Blood Therapeutics, Inc. (US) | 2018-12-26 | — | — | EP | disclosed |
| CN-107688069-A | The detection method of the dimethanol of (1R, 2R) hexamethylene 1,2 | 安徽灵药业有限公司 | 2018-02-13 | — | — | CN | disclosed |
| WO-2017142947-A1 | HISTONE METHYLTRANSFERASE INHIBITORS | GLOBAL BLOOD THERAPEUTICS, INC. (US) | 2017-08-24 | — | — | WO | disclosed |
| EP-2726482-A1 | HYDROXYMETHYLARYL-SUBSTITUTED PYRROLOTRIAZINES AS ALK1 INHIBITORS | Bayer Intellectual Property GmbH (DE) | 2014-05-07 | — | — | EP | disclosed |
| WO-2013004551-A1 | HYDROXYMETHYLARYL-SUBSTITUTED PYRROLOTRIAZINES AS ALK1 INHIBITORS | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2013-01-10 | — | — | WO | disclosed |
| CN-1324018-C | Oligopeptides and compositions containing them as cathepsin S inhibitors | AVENTIS PHARMA INC (US) | 2007-07-04 | — | — | CN | disclosed |
| CN-1585757-A | Oligopeptides and compositions containing them as cathepsin S inhibitors | AVENTIS PHARMA INC (US) | 2005-02-23 | — | — | CN | disclosed |
| US-6436980-B1 | TRANSPORT PROTEIN SUPPRESSORS; MICROBIOCIDES | ESSENTIAL THERAPEUTICS, INC. | 2002-08-20 | — | — | US | disclosed |
| US-3990988-A | HEXYL TRIFLUOROACETATE, 1-HEXANOL | PHILLIPS PETROLEUM COMPANY (US) | 1976-11-09 | — | — | US | disclosed |