Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19815026 | 0.83 | TP53 (0.47) | TP53GPR84ALDH1A1FFAR1GABRR1 | |
| SCHEMBL9308206 | 0.83 | ENPEP (0.43) | BLMGPR84ALDH1A1FFAR1CHRM1 | |
| SCHEMBL16600445 | 0.82 | GPR84 (0.58) | TP53BLMGPR84ALDH1A1FFAR1 | |
| SCHEMBL13431069 | 0.82 | BLM (0.61) | TP53BLMGPR84ALDH1A1FFAR1 | |
| SCHEMBL31268216 | 0.81 | BLM (0.60) | TP53BLMGABRR1CYP1A2 | |
| SCHEMBL19293365 | 0.80 | — | — | |
| SCHEMBL28578525 | 0.80 | — | — | |
| SCHEMBL424751 | 0.80 | — | — | |
| SCHEMBL3914418 | 0.80 | — | — | |
| SCHEMBL29093726 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3491044-A1 | METHOD OF REGIOSELECTIVE SYNTHESIS OF POLYESTERS FROM ASYMMETRIC DIOLS | Versalis S.p.A. (IT) | 2019-06-05 | — | — | EP | disclosed |
| WO-2018020440-A9 | METHOD OF REGIOSELECTIVE SYNTHESIS OF POLYESTERS FROM ASYMMETRIC DIOLS | VERSALIS S.P.A. (IT) | 2019-03-07 | — | — | WO | disclosed |
| WO-2018020440-A1 | METHOD OF REGIOSELECTIVE SYNTHESIS OF POLYESTERS FROM ASYMMETRIC DIOLS | VERSALIS S.P.A. (IT) | 2018-02-01 | — | — | WO | disclosed |