Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 13/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.49 |
| ▸ | USP2 | O75604 | 5/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2139692 | 0.84 | CHRM2 (0.58) | ACKR3PTGDR2 | |
| SCHEMBL12101047 | 0.76 | ADRB2 (0.39) | CYP3A4CYP2D6USP2TSHR | |
| SCHEMBL12100962 | 0.74 | CHRM2 (0.43) | CYP3A4CYP2D6USP2TSHRCYP1A2 | |
| SCHEMBL29944217 | 0.73 | HTR2C (0.63) | ALDH1A1HSD17B10PTGDR2MEN1KMT2A | |
| SCHEMBL3547467 | 0.73 | HTR2C (0.63) | ALDH1A1HSD17B10PTGDR2MEN1KMT2A | |
| SCHEMBL3543198 | 0.73 | HTR2C (0.63) | ALDH1A1HSD17B10PTGDR2MEN1KMT2A | |
| SCHEMBL12101040 | 0.72 | GRM5 (0.43) | CYP3A4CYP2D6USP2TSHRCYP1A2 | |
| SCHEMBL12101045 | 0.70 | CYP3A4 (0.39) | CYP3A4CYP2D6USP2TSHRCYP1A2 | |
| SCHEMBL12101084 | 0.69 | CYP3A4 (0.43) | CYP3A4CYP2D6USP2TSHRCYP1A2 | |
| SCHEMBL12101088 | 0.69 | CHRM2 (0.43) | CYP3A4CYP2D6USP2TSHRCYP1A2 |
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-2242759-B1 | COMPOUNDS | ASTRAZENECA AB (SE) | 2012-09-12 | — | — | EP | disclosed |