Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ANPEP | P15144 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.43 |
| ▸ | RXRA | P19793 | 2/20 | 0.42 |
| ▸ | RXRB | P28702 | 2/20 | 0.42 |
| ▸ | DRD1 | P21728 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28095147 | 0.83 | ALDH1A1 (0.53) | ALDH1A1HTTMAPTSMN1; SMN2SRD5A2 | |
| SCHEMBL9203574 | 0.82 | TSHR (0.50) | ALDH1A1TP53TSHRANPEPSMN1; SMN2 | |
| SCHEMBL938192 | 0.81 | ALDH1A1 (0.56) | ALDH1A1TP53TSHRHTTANPEP | |
| SCHEMBL19922225 | 0.81 | MAPK1 (0.45) | ALDH1A1TP53TSHRANPEPMAPT | |
| SCHEMBL8759187 | 0.79 | MAPT (0.50) | ALDH1A1TSHRMAPTCYP3A4CYP2D6 | |
| SCHEMBL13951793 | 0.79 | HDAC8 (0.63) | ALDH1A1TP53TSHRHTTANPEP | |
| SCHEMBL28261561 | 0.79 | TP53 (0.51) | ALDH1A1TP53TSHRMAPTKMT2A | |
| SCHEMBL7995537 | 0.78 | SRD5A2 (0.48) | HTTSMN1; SMN2SRD5A2CYP2D6CYP2C9 | |
| SCHEMBL14549283 | 0.78 | TSHR (0.56) | ALDH1A1TP53TSHRHTTANPEP | |
| SCHEMBL115710 | 0.78 | TSHR (0.56) | ALDH1A1TP53TSHRHTTANPEP |
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-1768988-B1 | NOVEL PHENYL-BORONIC ACID DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF | GALDERMA RES & DEV (FR) | 2009-01-28 | — | — | EP | disclosed |
| EP-1768988-A1 | NOVEL PHENYL-BORONIC ACID DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF | Galderma Research & Development, S.N.C. (FR) | 2007-04-04 | — | — | EP | disclosed |
| WO-2005061520-A1 | NOVEL PHENYL-BORONIC ACID DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF | GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) | 2005-07-07 | — | — | WO | disclosed |