Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | CCKBR | P32239 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9136909 | 0.71 | CES1 (0.38) | CES1TTRBRPF1BCHEGABRA1 | |
| SCHEMBL16786519 | 0.70 | MAOA (0.48) | CES1TTRBRPF1MEN1KMT2A | |
| SCHEMBL4420912 | 0.69 | BRPF1 (0.53) | CES1TTRBRPF1GABRA1GABRG2 | |
| SCHEMBL6518017 | 0.69 | BRPF1 (0.53) | CES1TTRBRPF1GABRA1GABRG2 | |
| SCHEMBL3275841 | 0.67 | CES1 (0.52) | CES1BCHEMEN1KMT2ACASP3 | |
| SCHEMBL9295437 | 0.66 | TTR (0.42) | CES1TTRBRPF1GABRA1GABRG2 | |
| SCHEMBL14596647 | 0.64 | SETD7 (0.42) | CES1TTRGABRA1GABRG2GABRB3 | |
| SCHEMBL21311772 | 0.64 | CES1 (0.58) | CES1TTRBCHEGABRA1GABRG2 | |
| SCHEMBL13636983 | 0.64 | — | — | |
| SCHEMBL4571020 | 0.64 | MAOA (0.60) | CES1TTRBRPF1MEN1KMT2A |
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-5405968-A | Useful as drugs, for producing singlet oxygen, sensitizers in electrophotographic layers and for photopolymerizations and as laser light sensitive dyes in optical recording media | BASF AKTIENGESELLSCHAFT (DE) | 1995-04-11 | — | — | US | disclosed |