Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 10/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | NR3C1 | P04150 | 7/20 | 0.50 |
| ▸ | PGR | P06401 | 5/20 | 0.50 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.50 |
| ▸ | AR | P10275 | 2/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3403972 | 1.00 | HIF1A (0.59) | HIF1ACYP3A4HSD17B10ALDH1A1CYP2C9 | |
| SCHEMBL3403977 | 1.00 | HIF1A (0.59) | HIF1ACYP3A4HSD17B10ALDH1A1CYP2C9 | |
| SCHEMBL13102560 | 0.92 | HIF1A (0.58) | HIF1ACYP3A4HSD17B10ALDH1A1CYP2C9 | |
| SCHEMBL16613937 | 0.83 | HIF1A (0.59) | HIF1ACYP3A4HSD17B10TSHRNR3C1 | |
| SCHEMBL21278181 | 0.83 | HIF1A (0.59) | HIF1ACYP3A4HSD17B10TSHRNR3C1 | |
| SCHEMBL13148408 | 0.83 | HIF1A (0.59) | HIF1ACYP3A4HSD17B10TSHRNR3C1 | |
| SCHEMBL3406165 | 0.82 | HIF1A (0.85) | HIF1ACYP3A4HSD17B10ALDH1A1CYP2C9 | |
| SCHEMBL13103471 | 0.76 | HSP90AA1 (0.55) | HIF1ACYP3A4HSD17B10ALDH1A1CYP2C9 | |
| SCHEMBL13150608 | 0.76 | HSP90AA1 (0.55) | HIF1ACYP3A4HSD17B10ALDH1A1CYP2C9 | |
| SCHEMBL3408147 | 0.76 | HSP90AA1 (0.55) | HIF1ACYP3A4HSD17B10ALDH1A1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010114476-A1 | NOVEL DERIVATIVES OF STEROIDAL[3,2-C]PYRAZOLE COMPOUNDS WITH GLUCOCORTICOID ACTIVITY | ASTRAZENECA AB (SE) | 2010-10-07 | — | — | WO | disclosed |