Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CAMKK2 | Q96RR4 | 3/20 | 0.39 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27436953 | 0.91 | PTGDR2 (0.44) | PTGDR2NPC1RAB9AKMT2ATAS1R3 | |
| SCHEMBL18304696 | 0.88 | PTGDR2 (0.57) | PTGDR2NPC1RAB9ACAMKK2ABCC1 | |
| SCHEMBL5728643 | 0.86 | PTGDR2 (0.51) | PTGDR2NPC1RAB9AKMT2AGAA | |
| SCHEMBL27832639 | 0.84 | PTGDR2 (0.53) | PTGDR2NPC1RAB9AKMT2AGAA | |
| SCHEMBL9220646 | 0.84 | PTGDR2 (0.50) | PTGDR2NPC1RAB9AKMT2AGAA | |
| SCHEMBL27832665 | 0.82 | PTGDR2 (0.51) | PTGDR2NPC1RAB9AKMT2AGAA | |
| SCHEMBL4334283 | 0.81 | PTGDR2 (0.47) | PTGDR2NPC1RAB9AKMT2AKDM4E | |
| SCHEMBL11160966 | 0.79 | PTGDR2 (0.55) | PTGDR2KMT2AKDM4EMEN1MAPT | |
| SCHEMBL12488847 | 0.79 | PTGDR2 (0.48) | PTGDR2NPC1RAB9AGAATAS1R3 | |
| SCHEMBL16421197 | 0.79 | CSNK2A1 (0.48) | PTGDR2KMT2AMEN1MAPTDRD2 |
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-102329267-A | 6-substituted 2,3,4, 5-tetrahydro-1H-benzo [d] aza as 5-HT2Creceptor agonists | LILLY CO ELI | 2012-01-25 | — | — | CN | disclosed |
| CN-102311387-A | 6-substituted 2,3,4, 5-tetrahydro-1H-benzo [d] aza as 5-HT2Creceptor agonists | LILLY CO ELI | 2012-01-11 | — | — | CN | disclosed |
| CN-1934088-A | As 5-HT2c6-substituted 2,3,4, 5-tetrahydro-1H-benzo [ d ] receptor agonists]Aza * | LILLY CO ELI (US) | 2007-03-21 | — | — | CN | disclosed |