Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | FPR2 | P25090 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10832477 | 0.93 | L3MBTL1 (0.50) | ESR1ESR2ALDH1A1KMT2AHSP90AA1 | |
| SCHEMBL10832866 | 0.84 | L3MBTL1 (0.56) | ESR1ESR2ALDH1A1KMT2APOLB | |
| SCHEMBL2040594 | 0.83 | ESR1 (0.46) | ESR1ESR2ALDH1A1KMT2AHDAC1 | |
| SCHEMBL10833316 | 0.82 | ALDH1A1 (0.49) | ALDH1A1KMT2AKDM4ETAAR1 | |
| SCHEMBL19586242 | 0.81 | HPGD (0.49) | ESR1ESR2ALDH1A1KMT2AHDAC1 | |
| SCHEMBL11852062 | 0.81 | ESR1 (0.45) | ESR1ESR2ALDH1A1KMT2AHDAC1 | |
| SCHEMBL27496475 | 0.81 | KMT2A (0.53) | ESR1ESR2ALDH1A1KMT2APOLB | |
| SCHEMBL29170075 | 0.80 | ESR1 (0.50) | ESR1ESR2ALDH1A1KMT2AHDAC1 | |
| SCHEMBL1966465 | 0.80 | L3MBTL1 (0.45) | ESR1ESR2ALDH1A1KMT2AHDAC1 | |
| SCHEMBL10832377 | 0.80 | ESR1 (0.48) | ESR1ESR2ALDH1A1KMT2APOLB |
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-4598085-A | Fungicidal 1-(2-aryl-2-R-ethyl)-1H-1,2,4-triazoles | JANSSEN PHARMACEUTICA N.V. (BE) | 1986-07-01 | — | — | US | disclosed |