Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.54 |
| ▸ | ELANE | P08246 | 6/20 | 0.54 |
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.50 |
| ▸ | BAX | Q07812 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | AR | P10275 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13347335 | 0.94 | ELANE (0.60) | ESR1ESR2CYP3A4ALDH1A1SRD5A2 | |
| SCHEMBL12890394 | 0.94 | ELANE (0.60) | ESR1ESR2CYP3A4ALDH1A1SRD5A2 | |
| SCHEMBL10334166 | 0.94 | SRD5A2 (0.61) | ESR1ESR2CYP3A4ALDH1A1SRD5A2 | |
| SCHEMBL10930836 | 0.91 | SRD5A2 (0.61) | SRD5A2ELANEMAPTPOLB | |
| SCHEMBL17879954 | 0.91 | SRD5A2 (0.66) | SRD5A2ELANERAB9ANPC1PARP10 | |
| SCHEMBL16078745 | 0.88 | ELANE (0.59) | ESR1ESR2CYP3A4ALDH1A1ELANE | |
| SCHEMBL13978720 | 0.88 | ELANE (0.51) | ESR1ESR2CYP3A4ALDH1A1SRD5A2 | |
| SCHEMBL19380455 | 0.88 | SRD5A2 (0.54) | ALDH1A1SRD5A2ELANELTA4HRAB9A | |
| SCHEMBL18978131 | 0.88 | LTA4H (0.58) | ESR1ESR2CYP3A4ALDH1A1ELANE | |
| SCHEMBL12277343 | 0.88 | ELANE (0.54) | ESR1ESR2CYP3A4ALDH1A1SRD5A2 |
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-20140275472-A1 | SYNTHESIS OF AND CURING ADDITIVES FOR PHTHALONITRILES | THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2014-09-18 | — | — | US | disclosed |