Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | CCR5 | P51681 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30219182 | 1.00 | PTGDR2 (0.43) | PTGDR2CYP2A6CCR5SLC6A2SLC6A4 | |
| SCHEMBL19603220 | 0.91 | PTGDR2 (0.43) | PTGDR2CYP2A6CCR5SLC6A2SLC6A4 | |
| SCHEMBL29417721 | 0.86 | PTGDR2 (0.48) | PTGDR2CYP2A6SLC6A2SLC6A4NPC1 | |
| SCHEMBL3390800 | 0.86 | CYP2A6 (0.48) | PTGDR2CYP2A6CCR5ALDH1A1MAPT | |
| SCHEMBL795719 | 0.86 | PTGDR2 (0.48) | PTGDR2CYP2A6SLC6A2SLC6A4NPC1 | |
| SCHEMBL8128901 | 0.80 | PTGDR2 (0.44) | PTGDR2SLC6A2SLC6A4NPC1SLC6A3 | |
| SCHEMBL16793967 | 0.79 | CYP2A6 (0.41) | PTGDR2CYP2A6CCR5SLC6A2SLC6A4 | |
| SCHEMBL29676561 | 0.79 | CYP2A6 (0.41) | PTGDR2CYP2A6CCR5SLC6A2SLC6A4 | |
| SCHEMBL31185057 | 0.78 | PTGDR2 (0.43) | PTGDR2SLC6A2SLC6A4NPC1SLC6A3 | |
| SCHEMBL22604398 | 0.78 | PTGDR2 (0.43) | PTGDR2SLC6A2SLC6A4NPC1SLC6A3 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115667269-A | Pyridone-containing fused ring derivative inhibitor, and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-01-31 | — | — | CN | disclosed |
| WO-2021249522-A1 | PYRIDONE-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2021-12-16 | — | — | WO | disclosed |
| CN-106459002-A | Biaryl compounds useful in the treatment of human oncological, neurological and immunological diseases | 比奥根MA公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-104903296-A | Dihydropyrazole GPR40 modulators | BRISTOL MYERS SQUIBB CO | 2015-09-09 | — | — | CN | disclosed |
| CN-102803238-A | Oxadiazole derivatives | MERCK SERONO SA | 2012-11-28 | — | — | CN | disclosed |
| CN-101094827-B | Benzene compound having two or more substituents | DAIICHI SANKYO CO LTD | 2012-06-13 | — | — | CN | disclosed |
| CN-102459206-A | Oxadiazole derivatives | MERCK SERONO SA | 2012-05-16 | — | — | CN | disclosed |
| CN-101792436-A | Benzimidazole derivatives used in the treatment of diseases associated with vanilloid receptor 1 | ASTRAZENECA R & D SODERTALJE | 2010-08-04 | — | — | CN | disclosed |
| CN-101522637-A | Benzimidazole derivatives useful for the treatment of vanilloid receptor 1-related disorders | ASTRAZENECA AB (SE) | 2009-09-02 | — | — | CN | disclosed |
| CN-101203512-A | Heterocyclic compounds | DAIICHI SANKYO CO LTD (JP) | 2008-06-18 | — | — | CN | disclosed |
| CN-101094827-A | Benzene compound having two or more substituents | SANKYO CO (JP) | 2007-12-26 | — | — | CN | disclosed |