Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 2/20 | 0.32 |
| ▸ | RXRB | P28702 | 2/20 | 0.32 |
| ▸ | RXRG | P48443 | 2/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5663559 | 0.88 | HMGCR (0.41) | HMGCRSMN1; SMN2TP53CYP3A4MAPT | |
| SCHEMBL5668606 | 0.84 | HMGCR (0.39) | HMGCRSMN1; SMN2TP53CYP3A4MAPT | |
| SCHEMBL5668493 | 0.82 | ALOX5 (0.39) | HMGCRSMN1; SMN2CYP3A4KMT2ACYP1A2 | |
| SCHEMBL6685260 | 0.81 | RXRA (0.36) | RXRA | |
| SCHEMBL5666378 | 0.75 | HMGCR (0.44) | HMGCRSMN1; SMN2TP53CYP3A4MAPT | |
| SCHEMBL6681212 | 0.75 | HMGCR (0.43) | HMGCRSMN1; SMN2TP53CYP3A4MAPT | |
| SCHEMBL5670145 | 0.75 | HMGCR (0.43) | HMGCRSMN1; SMN2TP53CYP3A4MAPT | |
| SCHEMBL5668629 | 0.73 | HMGCR (0.53) | HMGCRSMN1; SMN2TP53CYP3A4MAPT | |
| SCHEMBL5668624 | 0.73 | HMGCR (0.53) | HMGCRSMN1; SMN2TP53CYP3A4MAPT | |
| SCHEMBL5669988 | 0.72 | HMGCR (0.49) | HMGCRSMN1; SMN2TP53CYP3A4MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004026242-A2 | SUBSTITUTED KETOPHOSPHONATE INHIBITORS OF TUMOR CELL PROLIFERATION | ILEX ONCOLOGY RESEARCH, SARL (CH) | 2004-04-01 | — | — | WO | claimed |
| WO-2004026243-A2 | THERAPEUTIC USES OF LINEAR KETOPHOSPHONATES | ILEX ONCOLOGY RESEARCH, SARL (CH) | 2004-04-01 | — | — | WO | disclosed |