Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.66 |
| ▸ | TDO2 | P48775 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.38 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.38 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16471414 | 0.78 | PTGS2 (0.54) | PTGS2ALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL617700 | 0.78 | FYN (0.54) | PTGS2CYP19A1GAA | |
| SCHEMBL10188824 | 0.75 | PTGS2 (0.50) | PTGS2ALDH1A1SMN1; SMN2 | |
| SCHEMBL617854 | 0.67 | PTGS2 (0.50) | PTGS2 | |
| SCHEMBL16702638 | 0.64 | TDO2 (0.59) | PTGS2TDO2ALDH1A1CYP3A4TDP1 | |
| SCHEMBL1665775 | 0.64 | USP7 (0.53) | ALDH1A1TP53CYP3A4TDP1KDM4E | |
| SCHEMBL9359942 | 0.62 | CYP3A4 (0.54) | ALDH1A1TP53CYP3A4TDP1KDM4E | |
| SCHEMBL2024128 | 0.61 | CYP3A4 (1.00) | ALDH1A1TP53CYP3A4TDP1KDM4E | |
| SCHEMBL258287 | 0.61 | CYP3A4 (1.00) | ALDH1A1TP53CYP3A4TDP1KDM4E | |
| SCHEMBL28842081 | 0.61 | CYP3A4 (1.00) | ALDH1A1TP53CYP3A4TDP1KDM4E |
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-0414570-A2 | Material of construction for the inside of the fan case of a turbofan engine and the method of preparing the same | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-02-27 | — | — | EP | disclosed |