Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10833308 | 0.82 | ESR1 (0.53) | ALDH1A1KMT2AKDM4ETAAR1 | |
| SCHEMBL10833718 | 0.77 | TAAR1 (0.44) | ALDH1A1MTNR1AMTNR1BSMN1; SMN2KMT2A | |
| SCHEMBL10832477 | 0.76 | L3MBTL1 (0.50) | ALDH1A1SMN1; SMN2KMT2AMEN1HTT | |
| SCHEMBL2040594 | 0.75 | ESR1 (0.46) | ALDH1A1KMT2AHPGD | |
| SCHEMBL7061430 | 0.74 | MTNR1A (0.56) | ALDH1A1MTNR1AMTNR1BKMT2AHPGD | |
| SCHEMBL10833135 | 0.74 | KDM4E (0.50) | ALDH1A1SMN1; SMN2KMT2AHPGDMEN1 | |
| SCHEMBL11852062 | 0.74 | ESR1 (0.45) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL19586242 | 0.74 | HPGD (0.49) | ALDH1A1KMT2AHPGDMEN1HTT | |
| SCHEMBL27496475 | 0.73 | KMT2A (0.53) | ALDH1A1SMN1; SMN2KMT2AHPGDMEN1 | |
| SCHEMBL9812912 | 0.73 | POLB (0.50) | ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E |
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 |