Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.76 |
| ▸ | NPC1 | O15118 | 5/20 | 0.63 |
| ▸ | RAB9A | P51151 | 5/20 | 0.63 |
| ▸ | PKM | P14618 | 2/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 2/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.59 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.59 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.59 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.59 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.59 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.59 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL626827 | 1.00 | GAA (0.76) | GAANPC1RAB9APKMSMN1; SMN2 | |
| Bromide SCHEMBL11500766 | 0.98 | GAA (0.73) | GAANPC1RAB9APKMSMN1; SMN2 | |
| Trifluoromethylbenzene SCHEMBL10520526 | 0.87 | GAA (0.58) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL6245092 | 0.86 | GAA (1.00) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL2562391 | 0.86 | GAA (0.71) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL9689348 | 0.84 | GAA (0.79) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL4491035 | 0.83 | GAA (0.79) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL7006640 | 0.83 | GAA (0.79) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL23976543 | 0.83 | GAA (0.67) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL10790442 | 0.83 | HDAC3 (0.70) | GAANPC1RAB9APKMSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110945007-B | 15 beta- [ 3-propionylamino ] -substituted estra-1, 3,5 (10) -trien-17-one compounds and 17-oximes thereof for inhibiting 17 beta-hydroxysteroid dehydrogenases | 佛恩多制药有限公司 | 2022-11-18 | — | — | CN | claimed |
| CN-115716860-A | 15 beta- [ 3-propionylamino ] -substituted estra-1, 3,5 (10) -trien-17-ones and 17-oximes | 佛恩多制药有限公司 | 2023-02-28 | — | — | CN | disclosed |
| CN-110945007-B | 15 beta- [ 3-propionylamino ] -substituted estra-1, 3,5 (10) -trien-17-one compounds and 17-oximes thereof for inhibiting 17 beta-hydroxysteroid dehydrogenases | 佛恩多制药有限公司 | 2022-11-18 | — | — | CN | disclosed |