Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | CHKA | P35790 | 1/20 | 0.59 |
| ▸ | HTR6 | P50406 | 9/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14924098 | 0.87 | KDM4E (0.48) | ALDH1A1KDM4EPOLBTDP1CHKA | |
| SCHEMBL20884932 | 0.84 | HTR6 (0.44) | ALDH1A1KDM4EPOLBTDP1CHKA | |
| SCHEMBL25592349 | 0.83 | ALDH1A1 (0.46) | ALDH1A1KDM4EPOLBTDP1CHKA | |
| SCHEMBL14200340 | 0.83 | ALDH1A1 (0.46) | ALDH1A1KDM4EPOLBTDP1CHKA | |
| SCHEMBL14924088 | 0.82 | HTR6 (0.47) | ALDH1A1KDM4EPOLBTDP1CHKA | |
| SCHEMBL2656580 | 0.81 | KDM4E (0.88) | ALDH1A1KDM4EPOLBTDP1CHKA | |
| SCHEMBL6894415 | 0.80 | LMNA (0.68) | ALDH1A1KDM4ECHKAHTR6SIGMAR1 | |
| SCHEMBL17918745 | 0.80 | ALDH1A1 (0.66) | ALDH1A1KDM4EPOLBTDP1CHKA | |
| SCHEMBL15371491 | 0.78 | NR1H2 (0.67) | ALDH1A1KDM4EPOLBHTR6LMNA | |
| SCHEMBL591420 | 0.78 | ALDH1A1 (0.64) | ALDH1A1KDM4EPOLBTDP1CHKA |
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-8623889-B2 | Substituted 6,6-fused nitrogenous heterocyclic compounds and uses thereof | GENENTECH, INC. (US) | 2014-01-07 | — | — | US | disclosed |