Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.58 |
| ▸ | TSHR | P16473 | 3/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.58 |
| ▸ | ESR1 | P03372 | 2/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | KDR | P35968 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 6/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | STS | P08842 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9680259 | 1.00 | ALDH1A1 (0.58) | ALDH1A1TSHRTDP1ESR1CHRM1 | |
| SCHEMBL11860527 | 0.92 | ALDH1A1 (0.68) | ALDH1A1TSHRTDP1ESR1CHRM1 | |
| SCHEMBL11860535 | 0.92 | ALDH1A1 (0.68) | ALDH1A1TSHRTDP1ESR1CHRM1 | |
| SCHEMBL9679747 | 0.91 | ESR1 (0.60) | ALDH1A1TSHRESR1LMNARAB9A | |
| SCHEMBL9679756 | 0.91 | ESR1 (0.60) | ALDH1A1TSHRESR1LMNARAB9A | |
| SCHEMBL9678892 | 0.90 | ALDH1A1 (0.70) | ALDH1A1TSHRTDP1ESR1CHRM1 | |
| SCHEMBL9679633 | 0.90 | MAPT (0.58) | ALDH1A1TSHRESR1LMNARAB9A | |
| SCHEMBL9679640 | 0.90 | MAPT (0.58) | ALDH1A1TSHRESR1LMNARAB9A | |
| SCHEMBL9678906 | 0.87 | CA12 (0.56) | ALDH1A1TSHRTDP1ESR1LMNA | |
| SCHEMBL9678915 | 0.87 | CA12 (0.56) | ALDH1A1TSHRTDP1ESR1LMNA |
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 |