Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.56 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6611353 | 0.81 | SLC6A3 (0.49) | KDM1A | |
| SCHEMBL13729451 | 0.73 | KDM1A (0.55) | KDM1ACES2CES1BRD4CREBBP | |
| SCHEMBL816885 | 0.73 | KDM1A (0.42) | KDM1ACYP1A2GRIK2 | |
| SCHEMBL817420 | 0.73 | KDM1A (0.50) | KDM1ACHRM3 | |
| SCHEMBL817793 | 0.72 | KDM1A (0.45) | KDM1A | |
| SCHEMBL18173412 | 0.72 | KDM1A (1.00) | KDM1ACES2CES1CHRM3CYP1A2 | |
| SCHEMBL18173410 | 0.72 | KDM1A (1.00) | KDM1ACES2CES1CHRM3CYP1A2 | |
| SCHEMBL10842594 | 0.71 | KDM1A (0.52) | KDM1ACES2CES1BRD4CREBBP | |
| Hydrochloric Acid SCHEMBL18172775 | 0.71 | KDM1A (0.96) | KDM1ACES2CES1CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL18172772 | 0.71 | KDM1A (0.96) | KDM1ACES2CES1CYP1A2CYP2C19 |
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-20110275756-A1 | CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER COMPOSITION, AND METHOD FOR PRODUCING CONJUGATED DIENE POLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-11-10 | — | — | US | disclosed |