Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16096026 | 0.88 | CYP1A2 (0.52) | CYP1A2CYP2C19CYP2D6SIGMAR1KCNH2 | |
| SCHEMBL17499639 | 0.88 | CYP1A2 (0.52) | CYP1A2CYP2C19CYP2D6SIGMAR1KCNH2 | |
| SCHEMBL28039868 | 0.78 | SIGMAR1 (0.43) | SIGMAR1KCNH2CA12HRH3TAAR1 | |
| SCHEMBL28039851 | 0.77 | SIGMAR1 (0.46) | SIGMAR1KCNH2HRH3TAAR1AOC3 | |
| SCHEMBL17499453 | 0.76 | SIGMAR1 (0.42) | CYP1A2CYP2C19CYP2D6SIGMAR1KCNH2 | |
| SCHEMBL17499550 | 0.76 | CYP1A2 (0.50) | CYP1A2CYP2C19CYP2D6KDM4ENPC1 | |
| SCHEMBL16096140 | 0.76 | CYP1A2 (0.50) | CYP1A2CYP2C19CYP2D6KDM4ENPC1 | |
| SCHEMBL17499552 | 0.76 | CYP1A2 (0.50) | CYP1A2CYP2C19CYP2D6KDM4ENPC1 | |
| SCHEMBL16098075 | 0.76 | ALDH1A1 (0.47) | CYP1A2CYP2C19CYP2D6KDM4ENPC1 | |
| SCHEMBL16098074 | 0.76 | ALDH1A1 (0.47) | CYP1A2CYP2C19CYP2D6KDM4ENPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105209268-B | Heterocyclic imine functionalized polymers | 株式会社普利司通 | 2018-05-04 | — | — | CN | disclosed |
| CN-105209268-A | Heterocyclic imine functionalized polymers | BRIDGESTONE CORP | 2015-12-30 | — | — | CN | disclosed |