Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 4/20 | 0.46 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | ACP3 | P15309 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 5/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.38 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.38 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.38 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12084095 | 0.92 | ACP3 (0.51) | PDE2AACP3ALDH1A1TSHRKIF11 | |
| SCHEMBL23060228 | 0.81 | PDE2A (0.46) | PDE2ACES2CES1ACP3ALDH1A1 | |
| SCHEMBL19772099 | 0.79 | PDE2A (0.48) | PDE2ACES2CES1ACP3ALDH1A1 | |
| SCHEMBL19772091 | 0.79 | PDE2A (0.48) | PDE2ACES2CES1ACP3ALDH1A1 | |
| SCHEMBL16230724 | 0.79 | PDE2A (0.48) | PDE2ACES2CES1ACP3ALDH1A1 | |
| SCHEMBL18358442 | 0.77 | CES2 (0.53) | PDE2ACES2CES1ACP3KIF11 | |
| Hydrochloric Acid SCHEMBL18247977 | 0.77 | PDE2A (0.47) | PDE2ACES2CES1ACP3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL20494402 | 0.77 | PDE2A (0.47) | PDE2ACES2CES1ACP3ALDH1A1 | |
| SCHEMBL22402532 | 0.77 | PDE2A (0.47) | PDE2ACES2CES1ACP3ALDH1A1 | |
| SCHEMBL13328621 | 0.76 | PDE2A (0.50) | PDE2ACES2CES1ACP3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7820704-B2 | Substituted heteroaryl derivatives, compositions, and methods of use | TRANSTECH PHARMA, INC. (US) | 2010-10-26 | — | — | US | disclosed |