Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.31 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16760866 | 0.89 | TDP1 (0.44) | TDP1CYP3A4ACHETSHRESR1 | |
| SCHEMBL3717033 | 0.86 | CYP3A4 (0.57) | TDP1CYP3A4ACHETSHRESR1 | |
| SCHEMBL4480 | 0.83 | TSHR (0.53) | TDP1CYP3A4ACHETSHRESR1 | |
| SCHEMBL29357701 | 0.83 | TSHR (0.53) | TDP1CYP3A4ACHETSHRESR1 | |
| SCHEMBL3127305 | 0.83 | TSHR (0.53) | TDP1CYP3A4ACHETSHRESR1 | |
| SCHEMBL6252132 | 0.81 | ACHE (0.43) | TDP1CYP3A4ACHETSHRESR1 | |
| SCHEMBL1991572 | 0.81 | TSHR (0.50) | TDP1CYP3A4ACHETSHRESR1 | |
| Bromide SCHEMBL3688252 | 0.81 | TSHR (0.50) | TDP1CYP3A4ACHETSHRESR1 | |
| SCHEMBL138533 | 0.81 | TSHR (0.50) | TDP1CYP3A4ACHETSHRESR1 | |
| Hydrochloric Acid SCHEMBL2857411 | 0.81 | TSHR (0.50) | TDP1CYP3A4ACHETSHRESR1 |
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-6350832-B1 | CATALYTIC COSSLINKING POLYMER OF POLYCYCLOOLEFIN MONOMER, MOLDING AND SHAPING IN THE PRESENCE OF GROUP 10 TRANSITION METAL AND ANION | THE B. F. GOODRICH COMPANY | 2002-02-26 | — | — | US | claimed |
| EP-1863747-A1 | HYDROFORMYLATION PROCESS WITH IMPROVED ISO-SELECTIVITY | Perstorp Specialty Chemicals AB (SE) | 2007-12-12 | — | — | EP | disclosed |
| WO-2006098685-A1 | HYDROFORMYLATION PROCESS WITH IMPROVED ISO-SELECTIVITY | PERSTORP SPECIALTY CHEMICALS AB (SE) | 2006-09-21 | — | — | WO | disclosed |