Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NQO1 | P15559 | 2/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11563555 | 0.80 | CA1 (0.49) | CYP1B1KDM4EALDH1A1GLACYP3A4 | |
| Phosphine SCHEMBL28097689 | 0.79 | CA1 (0.47) | CYP1B1KDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL12160830 | 0.74 | L3MBTL1 (0.41) | CYP1A1CYP1B1GPR84GSTP1ALDH1A1 | |
| SCHEMBL11573408 | 0.74 | HNF4A (0.49) | CYP1A1CYP1B1GPR84ALDH1A1CYP3A4 | |
| SCHEMBL8441434 | 0.74 | TTR (0.48) | KDM4EALDH1A1MAPTTDP1L3MBTL1 | |
| SCHEMBL124676 | 0.73 | MAPT (0.47) | CYP1A1CYP1B1GPR84GSTP1KDM4E | |
| SCHEMBL29875299 | 0.73 | MAPT (0.47) | CYP1A1CYP1B1GPR84GSTP1KDM4E | |
| SCHEMBL18907443 | 0.73 | AHR (0.47) | CYP1A1CYP1B1GPR84GSTP1KDM4E | |
| SCHEMBL21450732 | 0.72 | KDM4E (0.42) | CYP1A1CYP1B1GPR84GSTP1KDM4E | |
| SCHEMBL22062774 | 0.72 | MAPT (0.46) | CYP1A1CYP1B1KDM4EALDH1A1GLA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4371607-A | 4-Halogeno-5-(halogenomethyl-phenyl)-oxazole derivatives, a process for the preparation thereof, and radiation-sensitive compositions containing these derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-02-01 | — | — | US | disclosed |
| US-4017313-A | Photosensitive composition containing a leuco dye, a photosensitizer, an aromatic aldehyde and a secondary or tertiary amine and the use thereof in a direct-print process | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-04-12 | — | — | US | disclosed |