Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 4/20 | 0.37 |
| ▸ | CES1 | P23141 | 4/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.35 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 6/20 | 0.34 |
| ▸ | PPARD | Q03181 | 6/20 | 0.34 |
| ▸ | PPARA | Q07869 | 6/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 5/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TLR2 | O60603 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | FABP4 | P15090 | 2/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.34 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.34 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9706910 | 1.00 | TSHR (0.41) | TSHRHPGDFAAHCES2CES1 | |
| SCHEMBL3766034 | 0.84 | TSHR (0.39) | TSHRHPGDFAAHCES2CES1 | |
| SCHEMBL3766031 | 0.84 | TSHR (0.39) | TSHRHPGDFAAHCES2CES1 | |
| SCHEMBL23134130 | 0.76 | SPHK2 (0.41) | TSHRFAAHCES2CES1AKR1B1 | |
| SCHEMBL1203912 | 0.76 | CES2 (0.41) | TSHRCES2CES1AKR1B1PPARG | |
| SCHEMBL1203910 | 0.76 | CES2 (0.41) | TSHRCES2CES1AKR1B1PPARG | |
| SCHEMBL11068780 | 0.75 | CES2 (0.52) | TSHRCES2CES1PPARGPPARD | |
| SCHEMBL4791139 | 0.75 | CES2 (0.48) | TSHRCES2CES1AKR1B1PPARG | |
| SCHEMBL11068782 | 0.75 | CES2 (0.52) | TSHRCES2CES1PPARGPPARD | |
| SCHEMBL27777490 | 0.74 | TSHR (0.43) | TSHRCES2CES1PPARGPPARD |
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 |
|---|---|---|---|---|---|---|---|
| US-5173537-A | In the presence of bis(cyclopentadienyl) titanium compound | SHELL OIL COMPANY (US) | 1992-12-22 | — | — | US | disclosed |