Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.64 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.64 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.64 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.64 |
| ▸ | TLR4 | O00206 | 2/20 | 0.60 |
| ▸ | TLR2 | O60603 | 2/20 | 0.60 |
| ▸ | FAAH | O00519 | 4/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.48 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL26378417 | 0.88 | CHRNB4 (0.68) | CHRNB2CHRNA4CHRNB4CHRNA3TLR4 | |
| SCHEMBL26378416 | 0.88 | CHRNB2 (0.55) | CHRNB2CHRNA4CHRNB4CHRNA3TLR4 | |
| SCHEMBL15498205 | 0.87 | SLC6A2 (0.58) | CHRNB2CHRNA4CHRNB4CHRNA3TLR4 | |
| SCHEMBL9239686 | 0.82 | CHRNA3 (0.59) | CHRNB2CHRNA4CHRNB4CHRNA3FAAH | |
| SCHEMBL9239680 | 0.82 | CHRNA3 (0.59) | CHRNB2CHRNA4CHRNB4CHRNA3FAAH | |
| SCHEMBL4199942 | 0.82 | ALDH1A1 (0.66) | CHRNB2CHRNA4CHRNB4CHRNA3FAAH | |
| SCHEMBL4199938 | 0.82 | ALDH1A1 (0.66) | CHRNB2CHRNA4CHRNB4CHRNA3FAAH | |
| SCHEMBL4199936 | 0.82 | ALDH1A1 (0.66) | CHRNB2CHRNA4CHRNB4CHRNA3FAAH | |
| SCHEMBL3506236 | 0.81 | CHRNB4 (0.48) | CHRNB2CHRNA4CHRNB4CHRNA3TLR4 | |
| SCHEMBL3506910 | 0.81 | MAPT (0.56) | CHRNB2CHRNA4CHRNB4CHRNA3TLR4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106946848-A | It is used as the derivative of the pyridyl alkyl alcohol of 1 phenyl 2 of phosphodiesterase inhibitors | 奇斯药制品公司 | 2017-07-14 | — | — | CN | disclosed |
| EP-1948665-A2 | THIENOPYRIMIDINONE DERIVATIVES AS MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS | Bristol-Myers Squibb Company (US) | 2008-07-30 | — | — | EP | disclosed |
| WO-2007050726-A2 | THIENOPYRIMIDINONE DERIVATIVES AS MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-05-03 | — | — | WO | disclosed |