Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.63 |
| ▸ | PNMT | P11086 | 2/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.63 |
| ▸ | LMNA | P02545 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.58 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL320794 | 0.81 | P2RX7 (0.47) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL13145151 | 0.81 | P2RX7 (0.47) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL423182 | 0.81 | CYP1A2 (0.68) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL22801396 | 0.81 | CYP1A2 (0.68) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL11499495 | 0.81 | CYP1A2 (0.56) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL25392757 | 0.80 | P2RX7 (0.56) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL1281895 | 0.80 | P2RX7 (0.47) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL30785267 | 0.80 | P2RX7 (0.56) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL8440315 | 0.79 | P2RX7 (0.46) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL11501928 | 0.79 | CYP1A2 (0.65) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 |
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-0159915-A2 | Process for making ring-halogenated styrenes and their use | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) | 1985-10-30 | — | — | EP | claimed |
| CN-102666545-B | As the heterocycle Pyrazolopyrimidine analogs of JAK inhibitor | CELLZOME LTD. (GB) | 2016-04-06 | — | — | CN | disclosed |
| CN-104395310-A | Bicyclic substituted uracils and their use | Bayer Pharma AG | 2015-03-04 | — | — | CN | disclosed |
| CN-104039791-A | [1,2,3] triazolo [4,5-D ] pyrimidine derivatives as cannabinoid receptor 2 agonists | HOFFMANN LA ROCHE | 2014-09-10 | — | — | CN | disclosed |
| CN-103930426-A | [1, 2, 3] triazolo [4, 5 -d] pyrimidine derivatives as agonists of the cannabinoid receptor 2 | HOFFMANN LA ROCHE | 2014-07-16 | — | — | CN | disclosed |
| EP-0159915-A2 | Process for making ring-halogenated styrenes and their use | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) | 1985-10-30 | — | — | EP | disclosed |