Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.46 |
| ▸ | ANPEP | P15144 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 4/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 2/20 | 0.38 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7229901 | 0.78 | HTR2A (0.44) | HTR2ARETRAB9AIDO1 | |
| SCHEMBL19829905 | 0.75 | HTR2A (0.41) | HTR2AANPEPCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL19829949 | 0.75 | HTR2A (0.41) | HTR2AANPEPCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL19829951 | 0.75 | HTR2A (0.41) | HTR2AANPEPCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL19835488 | 0.75 | HTR2A (0.41) | HTR2AANPEPCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL19829904 | 0.75 | HTR2A (0.41) | HTR2AANPEPCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL19827839 | 0.75 | HTR2A (0.41) | HTR2AANPEPCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL11397671 | 0.75 | HTR2A (0.41) | HTR2AANPEPCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL19827837 | 0.75 | HTR2A (0.41) | HTR2AANPEPCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL117297 | 0.74 | CA9 (0.39) | RETNPC1RAB9ASMN1; SMN2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108368053-A | Substituted benzazepine derivatives as antibacterial compounds | 葛兰素史密斯克莱知识产权发展有限公司 | 2018-08-03 | — | — | CN | disclosed |
| CN-107108596-A | The oxazoline compound replaced by fused ring system | 巴斯夫欧洲公司 | 2017-08-29 | — | — | CN | disclosed |
| CN-103717597-B | Heterocyclic compounds as kinase inhibitors | 原真股份有限公司 | 2017-07-04 | — | — | CN | disclosed |
| CN-106660982-A | Histone demethylase inhibitors | 赛尔基因昆蒂赛尔研究公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-105209452-A | 4-amino-6- (heterocyclyl) pyridine-2-carboxylic acid esters and 6-amino-2- (heterocyclyl) pyrimidine-4-carboxylic acid esters and their use as herbicides | DOW AGROSCIENCES LLC | 2015-12-30 | — | — | CN | disclosed |
| CN-102803252-A | Indole amide derivatives and related compounds for use in the treatment of neurodegenerative diseases | UNIV LEUVEN KATH | 2012-11-28 | — | — | CN | disclosed |
| EP-1971595-A2 | CETP INHIBITORS | Merck & Co., Inc. (US) | 2008-09-24 | — | — | EP | disclosed |
| WO-2007081569-A2 | CETP INHIBITORS | MERCK & CO., INC. (US) | 2007-07-19 | — | — | WO | disclosed |