Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 15/20 | 1.00 |
| ▸ | TTR | P02766 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.46 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24268388 | 0.89 | AHR (0.79) | AHRTTRALDH1A1LMNAKMT2A | |
| SCHEMBL2282515 | 0.89 | AHR (0.78) | AHRTTRALDH1A1LMNAKMT2A | |
| SCHEMBL2278885 | 0.87 | AHR (0.77) | AHRTTRALDH1A1LMNAKDM4E | |
| SCHEMBL8128583 | 0.84 | AHR (0.73) | AHRTTRALDH1A1LMNAKMT2A | |
| SCHEMBL29403123 | 0.83 | AHR (1.00) | AHRLMNA | |
| SCHEMBL548471 | 0.83 | AHR (1.00) | AHRLMNA | |
| SCHEMBL20321518 | 0.79 | AHR (0.78) | AHRTTRALDH1A1KMT2AKDM4E | |
| SCHEMBL2281402 | 0.78 | AHR (0.77) | AHRTTRALDH1A1KMT2AKDM4E | |
| SCHEMBL29919005 | 0.78 | AHR (0.77) | AHRTTRALDH1A1KMT2AKDM4E | |
| SCHEMBL31596655 | 0.78 | AHR (0.77) | AHRTTRALDH1A1KMT2AKDM4E |
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-7996156-B2 | Methods for predicting properties of molecules | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-08-09 | — | — | US | disclosed |