Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 2/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CCR1 | P32246 | 2/20 | 0.34 |
| ▸ | CCR5 | P51681 | 2/20 | 0.34 |
| ▸ | CCR8 | P51685 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | METAP1 | P53582 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.34 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.34 |
| ▸ | RARG | P13631 | 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 | |
|---|---|---|---|---|
| SCHEMBL17645216 | 0.79 | KDM4E (0.39) | GRM4PIN1NPC1ALDH1A1CYP2D6 | |
| SCHEMBL409030 | 0.72 | KDM4E (0.55) | PIN1NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL28165762 | 0.71 | KDM4E (0.47) | GRM4PIN1NPC1ALDH1A1CYP2D6 | |
| SCHEMBL29539584 | 0.71 | KDM4E (0.56) | GRM4PIN1NPC1ALDH1A1CYP2D6 | |
| SCHEMBL18984732 | 0.71 | KDM4E (0.56) | GRM4PIN1NPC1ALDH1A1CYP2D6 | |
| Phosphine SCHEMBL17979775 | 0.70 | KDM4E (0.53) | PIN1NPC1ALDH1A1CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL28670387 | 0.70 | KDM4E (0.53) | PIN1NPC1ALDH1A1CYP2D6CYP2C19 | |
| Ethylene SCHEMBL27741856 | 0.68 | KDM4E (0.52) | PIN1NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL5174023 | 0.68 | KDM4E (0.46) | NPC1ALDH1A1KDM4ETDP1CCR1 | |
| SCHEMBL28165765 | 0.68 | CCR1 (0.47) | GRM4PIN1NPC1ALDH1A1CYP2D6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1720545-B1 | BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES | CHEMOCENTRYX INC (US) | 2014-10-29 | — | — | EP | disclosed |