Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 13/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 12/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | TYR | P14679 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | AR | P10275 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | HTR6 | P50406 | 1/20 | 0.54 |
| ▸ | ESRRG | P62508 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SHBG | P04278 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9316251 | 0.87 | TSHR (0.35) | ESR1ESR2CYP3A4LMNATYR | |
| SCHEMBL11598306 | 0.82 | ESR1 (0.50) | ESR1ESR2CYP3A4LMNATYR | |
| SCHEMBL7522468 | 0.77 | ESR1 (0.50) | ESR1ESR2CYP3A4LMNATYR | |
| SCHEMBL1244431 | 0.76 | ESR1 (0.55) | ESR1ESR2CYP3A4LMNATYR | |
| SCHEMBL18396557 | 0.76 | RAB9A (0.41) | ALDH1A1MEN1KMT2ANPC1MAPT | |
| SCHEMBL6209830 | 0.76 | KMT2A (0.50) | CYP3A4LMNATSHRSLC6A2SLC6A4 | |
| SCHEMBL56734 | 0.75 | MAPK1 (0.44) | ESR1ESR2CYP3A4TSHRALDH1A1 | |
| Bisphenol A SCHEMBL29415509 | 0.74 | ESR1 (0.73) | ESR1ESR2CYP3A4LMNATYR | |
| Bisphenol A SCHEMBL29848979 | 0.74 | ESR1 (0.73) | ESR1ESR2CYP3A4LMNATYR | |
| SCHEMBL159573 | 0.73 | KIF11 (0.46) | ALDH1A1MEN1KMT2AKDM4ENPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5319142-A | Process for preparing substituted and unsubstituted arylalkylamines | HOECHST CELANESE CORPORATION (US) | 1994-06-07 | — | — | US | claimed |