Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15957753 | 0.90 | ESR1 (0.63) | ESR1ESR2LMNAPDE10AMAPK1 | |
| SCHEMBL1664336 | 0.87 | ESR1 (0.60) | ESR1ESR2LMNAPDE10AMAPK1 | |
| SCHEMBL1484129 | 0.83 | MEN1 (0.66) | LMNAPDE10AMAPK1SMN1; SMN2HKDC1 | |
| SCHEMBL24099349 | 0.82 | POLB (0.51) | ESR1ESR2LMNAPDE10AMAPT | |
| SCHEMBL12605635 | 0.81 | ESR1 (0.54) | ESR1ESR2LMNAPDE10AMAPK1 | |
| SCHEMBL24099346 | 0.80 | POLB (0.49) | ESR1ESR2LMNAPDE10AMAPT | |
| SCHEMBL10446158 | 0.80 | TRPV1 (0.72) | ESR1ESR2MAPTKDM4EPOLB | |
| SCHEMBL4467032 | 0.79 | MAPK1 (0.76) | ESR1ESR2LMNAPDE10AMAPK1 | |
| SCHEMBL29110476 | 0.77 | POLB (0.61) | ESR1ESR2MAPK1POLBSMN1; SMN2 | |
| SCHEMBL5159193 | 0.77 | KMT2A (0.55) | LMNAPDE10APOLBSMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1755606-B2 | QUINAZOLINONE DERIVATIVES USEFUL AS VANILLOID ANTAGONISTS | NOVARTIS AG (CH) | 2011-06-29 | — | — | EP | disclosed |