Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.41 |
| ▸ | ERCC4 | Q92889 | 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 | |
|---|---|---|---|---|
| SCHEMBL283639 | 0.91 | IDO1 (0.62) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Methyl Alcohol SCHEMBL21223343 | 0.89 | MAPK1 (0.59) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL10581269 | 0.89 | IDO1 (0.60) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL4163742 | 0.89 | IDO1 (0.60) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| 1,2-Dichlorobenzene SCHEMBL11813576 | 0.83 | IDO1 (0.54) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Trimethylammonium SCHEMBL9757385 | 0.81 | KMT2A (0.44) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL16553471 | 0.78 | PYCR1 (0.61) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Methanesulfonic Acid Methyl Ester SCHEMBL19713558 | 0.77 | HTT (0.47) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL8648703 | 0.77 | PYCR1 (0.59) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9301276 | 0.76 | IDO1 (0.43) | IDO1CYP1A2CYP3A4CYP2C9CYP2C19 |
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-4147866-A | Process for preparing phosphorothioates and phenylphosphonothioates | THE DOW CHEMICAL COMPANY (US) | 1979-04-03 | — | — | US | disclosed |
| US-4096210-A | REACTING ALKALI METAL PHENATE, PYRIDINATE OR PYRIMIDATE WITH O,O-DIALKYLPHOSPHOROCHLORIDOTHIOATE OR O-ALKYL PHENYLPHOSPHONOCHLORIDOTHIOATE | THE DOW CHEMICAL COMPANY (US) | 1978-06-20 | — | — | US | disclosed |
| US-4007197-A | QUATERNARY AMMONIUM OR PHOSPHONIUM SALT AND TERTIARY AMINE CATALYST | THE DOW CHEMICAL COMPANY (US) | 1977-02-08 | — | — | US | disclosed |