Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30664032 | 0.80 | ALDH1A1 (0.38) | SMN1; SMN2ALOX15CYP3A4CASP1CASP7 | |
| SCHEMBL70554 | 0.75 | ALDH1A1 (0.48) | SMN1; SMN2ALOX15CYP3A4CASP1CASP7 | |
| SCHEMBL29882203 | 0.75 | ALDH1A1 (0.48) | SMN1; SMN2ALOX15CYP3A4CASP1CASP7 | |
| SCHEMBL8994564 | 0.75 | ALDH1A1 (0.48) | SMN1; SMN2ALOX15CYP3A4CASP1CASP7 | |
| SCHEMBL6173073 | 0.74 | IDO1 (0.41) | IDO1L3MBTL1ALDH1A1TDP1HTR2C | |
| SCHEMBL6447368 | 0.74 | TSHR (0.42) | ALOX15CASP1CASP7L3MBTL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4371044 | 0.73 | TDP1 (0.52) | SMN1; SMN2ALOX15CYP3A4CASP1CASP7 | |
| Fluoride SCHEMBL7897532 | 0.73 | POLB (0.46) | SMN1; SMN2ALOX15CYP3A4CASP1CASP7 | |
| Ammonia Solution, Strong SCHEMBL8056717 | 0.73 | POLB (0.46) | SMN1; SMN2ALOX15CYP3A4CASP1CASP7 | |
| Hydrogen Sulfide SCHEMBL11147516 | 0.73 | POLB (0.46) | SMN1; SMN2ALOX15CYP3A4CASP1CASP7 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016183101-A1 | PALLADIUM-CATALYZED ARYLATION OF FLUOROALKYLAMINES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2016-11-17 | — | — | WO | disclosed |
| WO-2016183101-A1 | PALLADIUM-CATALYZED ARYLATION OF FLUOROALKYLAMINES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2016-11-17 | — | — | WO | disclosed |
| US-6685793-B2 | PHOTOPOLYMERIZATION; EXPOSURE TO ACTINIC, ULTRAVIOLET RADIATION | 3M INNOVATIVE PROPERTIES COMPANY | 2004-02-03 | — | — | US | disclosed |
| US-4059626-A | Trifluoroethylanilines | PRODUITS CHIMIQUES UGINE KUHLMANN (FR) | 1977-11-22 | — | — | US | disclosed |
| US-4059626-A | Trifluoroethylanilines | PRODUITS CHIMIQUES UGINE KUHLMANN (FR) | 1977-11-22 | — | — | US | disclosed |
| US-4036962-A | BACTERICIDES | E. I. DU PONT DE NEMOURS AND CO. (US) | 1977-07-19 | — | — | US | disclosed |