Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.52 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.52 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.52 |
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.51 |
| ▸ | CDC25B | P30305 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21119051 | 0.83 | ALDH1A1 (0.64) | ALDH1A1NR4A1NR4A2NR4A3PDE10A | |
| SCHEMBL13313361 | 0.83 | CYP1A2 (0.60) | ALDH1A1PDE10ADHODHLMNATSHR | |
| SCHEMBL9330496 | 0.81 | PDE10A (0.58) | ALDH1A1PDE10ADHODHLMNATSHR | |
| SCHEMBL641899 | 0.81 | PDE10A (0.66) | ALDH1A1PDE10ADHODHLMNATSHR | |
| SCHEMBL29377848 | 0.81 | PDE10A (0.66) | ALDH1A1PDE10ADHODHLMNATSHR | |
| SCHEMBL7028209 | 0.79 | KMT2A (0.52) | ALDH1A1NR4A1NR4A2NR4A3PDE10A | |
| Iodide SCHEMBL8029601 | 0.79 | PDE10A (0.63) | ALDH1A1PDE10ADHODHLMNATSHR | |
| Hydrochloric Acid SCHEMBL9597551 | 0.79 | PDE10A (0.63) | ALDH1A1PDE10ADHODHLMNATSHR | |
| Iodide SCHEMBL8029606 | 0.79 | PDE10A (0.63) | ALDH1A1PDE10ADHODHLMNATSHR | |
| SCHEMBL68995 | 0.79 | ALDH1A1 (0.88) | ALDH1A1NR4A1NR4A2NR4A3DHODH |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5939568-A | Accelerated catalysis of olefinic epoxidations | THE SCRIPPS RESEARCH INSTITUTE (US) | 1999-08-17 | — | — | US | claimed |
| WO-1998033786-A9 | ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS | — | 1998-12-30 | — | — | WO | claimed |
| WO-1998033786-A1 | ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1998-08-06 | — | — | WO | claimed |
| EP-0904434-B1 | ACID-DYEABLE FIBRE | DSM NV (NL) | 2000-09-20 | — | — | EP | disclosed |
| US-6074749-A | POLYAMIDE HAVING AN AMINO END GROUP CONTENT OF LESS THAN 10 MEQ/KG | DSM N.V. (NL) | 2000-06-13 | — | — | US | disclosed |
| US-5939568-A | Accelerated catalysis of olefinic epoxidations | THE SCRIPPS RESEARCH INSTITUTE (US) | 1999-08-17 | — | — | US | disclosed |
| EP-0904434-A1 | ACID-DYEABLE FIBRE | DSM N.V. (NL) | 1999-03-31 | — | — | EP | disclosed |
| WO-1998033786-A9 | ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS | — | 1998-12-30 | — | — | WO | disclosed |
| WO-1998033786-A1 | ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1998-08-06 | — | — | WO | disclosed |
| WO-1997046746-A1 | ACID-DYEABLE FIBRE | DSM N.V. (NL) | 1997-12-11 | — | — | WO | disclosed |