Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.60 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | STS | P08842 | 7/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9679756 | 1.00 | ESR1 (0.60) | ESR1LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL9679640 | 0.96 | MAPT (0.58) | ESR1LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL9679633 | 0.96 | MAPT (0.58) | ESR1LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL11864516 | 0.92 | ESR1 (0.70) | ESR1LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL11864509 | 0.92 | ESR1 (0.70) | ESR1LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL9680263 | 0.91 | ALDH1A1 (0.58) | ESR1LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL9680259 | 0.91 | ALDH1A1 (0.58) | ESR1LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL7999502 | 0.91 | ESR1 (0.72) | ESR1LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL11857892 | 0.88 | ALDH1A1 (0.67) | ESR1LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL11857928 | 0.88 | ALDH1A1 (0.67) | ESR1LMNACYP1A2TSHRCYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5136013-A | Polyesters | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-04 | — | — | US | disclosed |
| US-5068300-A | BIFUNCTIONAL STILBENE COMPOUNDS CONTAINING AT LEAST ONE Z-CONFIGURATED STILBENE GROUP, PROCESS FOR THEIR PREPARATION AND THEIR USE FOR THE PREPARATION OF POLYMERS | BAYER AKTIENGESELLSCHAFT (DE) | 1991-11-26 | — | — | US | disclosed |