Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 3/20 | 0.79 |
| ▸ | PGR | P06401 | 9/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.65 |
| ▸ | HIF1A | Q16665 | 7/20 | 0.65 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.65 |
| ▸ | AR | P10275 | 4/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | F2 | P00734 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | USP2 | O75604 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11123589 | 1.00 | ABCB11 (0.79) | ABCB11PGRCYP3A4HIF1ANR3C1 | |
| SCHEMBL11124571 | 1.00 | ABCB11 (0.79) | ABCB11PGRCYP3A4HIF1ANR3C1 | |
| SCHEMBL22171557 | 1.00 | ABCB11 (0.79) | ABCB11PGRCYP3A4HIF1ANR3C1 | |
| SCHEMBL11274986 | 1.00 | ABCB11 (0.79) | ABCB11PGRCYP3A4HIF1ANR3C1 | |
| SCHEMBL13929945 | 0.92 | ABCB11 (0.73) | ABCB11PGRCYP3A4HIF1ANR3C1 | |
| SCHEMBL11070636 | 0.92 | PGR (0.74) | ABCB11PGRCYP3A4HIF1ANR3C1 | |
| SCHEMBL11127169 | 0.92 | PGR (0.74) | ABCB11PGRCYP3A4HIF1ANR3C1 | |
| SCHEMBL10803758 | 0.92 | PGR (0.70) | ABCB11PGRCYP3A4HIF1ANR3C1 | |
| SCHEMBL11127170 | 0.92 | PGR (0.74) | ABCB11PGRCYP3A4HIF1ANR3C1 | |
| SCHEMBL11127550 | 0.92 | PGR (0.74) | ABCB11PGRCYP3A4HIF1ANR3C1 |
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-4188322-A | Process for the preparation of 6-halo-pregnanes | BLASINACHIM S.P.A. (IT) | 1980-02-12 | — | — | US | disclosed |