Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | IAPP | P10997 | 3/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.44 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.42 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL12832384 | 0.85 | ESR1 (0.56) | HIF1ACYP1A2ESR1ESR2HCAR2 | |
| SCHEMBL23067196 | 0.85 | IAPP (0.57) | HIF1ACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL28659512 | 0.81 | ESR1 (0.55) | ESR1ESR2HCAR2IAPPALOX5 | |
| SCHEMBL755804 | 0.81 | GAA (0.64) | HIF1ACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL28055334 | 0.81 | SKP2 (0.49) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL1358498 | 0.81 | HIF1A (0.52) | HIF1ACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8340607 | 0.80 | GAA (0.71) | HIF1ACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1696094 | 0.80 | ESR1 (0.57) | HIF1ACYP1A2CYP3A4ESR1ESR2 | |
| SCHEMBL11218783 | 0.80 | THRA (0.57) | ESR1ESR2IAPPTHRATHRB | |
| SCHEMBL12246749 | 0.79 | MAPT (0.65) | HIF1ACYP1A2CYP3A4CYP2C9CYP2C19 |
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-3068443-B1 | RESIDUALIZING LINKERS AND USES THEREOF | CENTRE FOR PROBE DEV AND COMMERCIALIZATION (CA) | 2019-04-10 | — | — | EP | disclosed |