Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CCNC | P24863 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5643304 | 0.79 | CYP1A2 (0.51) | CNR2MEN1KMT2AALDH1A1RAB9A | |
| SCHEMBL3297331 | 0.76 | PTGS2 (0.43) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL19994372 | 0.75 | PARP1 (0.48) | CNR2MEN1TSHRKMT2AALDH1A1 | |
| SCHEMBL38010 | 0.75 | CNR2 (0.52) | CNR2MEN1TSHRKMT2AALDH1A1 | |
| SCHEMBL31202632 | 0.75 | CNR2 (0.52) | CNR2MEN1TSHRKMT2AALDH1A1 | |
| SCHEMBL31300141 | 0.74 | MAPK1 (0.41) | CNR2ALDH1A1L3MBTL1CCNCCDK8 | |
| SCHEMBL9367582 | 0.72 | ALDH1A1 (0.40) | CNR2MEN1TSHRKMT2AALDH1A1 | |
| SCHEMBL16498074 | 0.72 | CNR2 (0.44) | CNR2MEN1TSHRKMT2AALDH1A1 | |
| SCHEMBL2931849 | 0.71 | ALDH1A1 (0.39) | CNR2MEN1TSHRKMT2AALDH1A1 | |
| SCHEMBL23832364 | 0.71 | ALDH1A1 (0.50) | MEN1TSHRKMT2AALDH1A1NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3305789-A1 | NITROGEN-CONTAINING TRICYCLIC DERIVATIVE HAVING HIV REPLICATION INHIBITORY ACTIVITY | Shionogi & Co., Ltd. (JP) | 2018-04-11 | — | — | EP | disclosed |
| WO-2016194806-A1 | NITROGEN-CONTAINING TRICYCLIC DERIVATIVE HAVING HIV REPLICATION INHIBITORY ACTIVITY | 塩野義製薬株式会社 | 2016-12-08 | — | — | WO | disclosed |