Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 14/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 12/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | ESRRG | P62508 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1836839 | 0.89 | ALDH1A1 (0.52) | ALDH1A1TSHRTDP1ESR1ESR2 | |
| SCHEMBL7970297 | 0.86 | ESR1 (0.50) | ALDH1A1TSHRTDP1ESR1ESR2 | |
| SCHEMBL29381738 | 0.85 | TSHR (0.60) | ALDH1A1TSHRTDP1ESR1ESR2 | |
| SCHEMBL3152876 | 0.85 | TSHR (0.60) | ALDH1A1TSHRTDP1ESR1ESR2 | |
| SCHEMBL15459416 | 0.83 | ALDH1A1 (0.46) | ALDH1A1TSHRTDP1ESR1ESR2 | |
| SCHEMBL17716497 | 0.81 | ESR1 (0.56) | ALDH1A1TSHRTDP1ESR1ESR2 | |
| SCHEMBL10071947 | 0.81 | ESR1 (0.46) | ALDH1A1TSHRTDP1ESR1ESR2 | |
| SCHEMBL23905030 | 0.81 | ESR1 (0.63) | ALDH1A1TSHRESR1ESR2CYP3A4 | |
| Phenol SCHEMBL8467840 | 0.81 | ESR1 (0.57) | ALDH1A1TSHRTDP1ESR1ESR2 | |
| SCHEMBL68287 | 0.80 | ESR1 (0.62) | ALDH1A1TSHRESR1ESR2CYP3A4 |
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-6288206-B1 | MIXED WITH DYE; HEAT RESISTANCE, STABILITY; ELECTROOPTICS; | MOLECULAR OPTOELECTRONICS CORPORATION | 2001-09-11 | — | — | US | disclosed |
| WO-2000054103-A1 | CHIRAL POLYMER COMPOSITIONS EXHIBITING NONLINEAR OPTICAL PROPERTIES | MOLECULAR OPTOELECTRONICS CORPORATION (US) | 2000-09-14 | — | — | WO | disclosed |