Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL11542944 | 0.90 | SLC6A4 (0.56) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL170667 | 0.89 | ESR1 (0.53) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10839469 | 0.87 | SLC6A4 (0.54) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1760718 | 0.84 | CYP3A4 (0.46) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL14444744 | 0.80 | CYP17A1 (0.46) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL14448517 | 0.80 | LOXL2 (0.42) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL15958590 | 0.77 | SLC6A2 (0.41) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10435320 | 0.76 | SLC6A2 (0.58) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL18864372 | 0.76 | CYP3A4 (0.45) | SLC6A2SLC6A4SLC6A3CYP3A4CYP2C19 | |
| SCHEMBL22163128 | 0.75 | CYP3A4 (0.39) | ESR1ESR2SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5585439-A | LOW PROFILE ADDITIVE CONTAINING DIKETO GROUPS | OHIO STATE UNIVERSITY (US) | 1996-12-17 | — | — | US | disclosed |
| US-5561192-A | CONTAINING DIKETO GROUPS | THE OHIO STATE UNIVERSITY (US) | 1996-10-01 | — | — | US | disclosed |
| WO-1996011966-A1 | MODIFICATION OF UNSATURATED POLYESTER RESINS FOR VISCOSITY CONTROL | OHIO STATE UNIVERSITY (US) | 1996-04-25 | — | — | WO | disclosed |