Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 4/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1837685 | 0.91 | TSHR (0.52) | TSHRESR1GABRA1GABRB2LMNA | |
| SCHEMBL27703049 | 0.90 | TSHR (0.44) | TSHRESR1ESR2GABRA1GABRB2 | |
| SCHEMBL1176375 | 0.87 | TSHR (0.57) | TSHRESR1ESR2GABRA1GABRB2 | |
| Phenol SCHEMBL11672985 | 0.87 | TSHR (0.52) | TSHRESR1ESR2GABRA1GABRB2 | |
| SCHEMBL20520252 | 0.87 | TSHR (0.42) | TSHRESR1LMNACHRM2CHRM1 | |
| SCHEMBL20520270 | 0.87 | TSHR (0.42) | TSHRESR1LMNACHRM2CHRM1 | |
| SCHEMBL20520202 | 0.87 | TSHR (0.42) | TSHRESR1LMNACHRM2CHRM1 | |
| SCHEMBL20520231 | 0.87 | TSHR (0.42) | TSHRESR1LMNACHRM2CHRM1 | |
| SCHEMBL20520218 | 0.87 | TSHR (0.42) | TSHRESR1LMNACHRM2CHRM1 | |
| SCHEMBL20520215 | 0.87 | TSHR (0.42) | TSHRESR1LMNACHRM2CHRM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000054103-A1 | CHIRAL POLYMER COMPOSITIONS EXHIBITING NONLINEAR OPTICAL PROPERTIES | MOLECULAR OPTOELECTRONICS CORPORATION (US) | 2000-09-14 | — | — | WO | disclosed |