Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | BHMT | Q93088 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | EYA2 | O00167 | 1/20 | 0.30 |
| ▸ | APP | P05067 | 1/20 | 0.30 |
| ▸ | ACE | P12821 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2250788 | 0.81 | TDP1 (0.33) | CYP2D6CYP2C19BLMEYA2APP | |
| SCHEMBL2250779 | 0.81 | TDP1 (0.33) | CYP2D6CYP2C19BLMEYA2APP | |
| SCHEMBL9889117 | 0.79 | RNPEP (0.33) | BHMTCYP2C19BLMEYA2APP | |
| SCHEMBL9972817 | 0.77 | — | — | |
| SCHEMBL13148757 | 0.75 | — | — | |
| SCHEMBL8432965 | 0.74 | TDP1 (0.35) | BHMTCYP2C19BLMEYA2APP | |
| Hydrochloric Acid SCHEMBL28724663 | 0.72 | CYP2D6 (0.38) | CYP2D6HIF1ABHMTGMNNTP53 | |
| SCHEMBL3290225 | 0.72 | BHMT (0.37) | BHMTEYA2APPACETDP1 | |
| SCHEMBL3290209 | 0.72 | BHMT (0.37) | BHMTEYA2APPACETDP1 | |
| SCHEMBL13090504 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2007070245-A | BIODEGRADABLE AMINOPOLYCARBOXYLIC ACID DERIVATIVE | TOSOH CORP | 2007-03-22 | — | — | JP | disclosed |