Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4607733 | 0.88 | POLB (0.40) | ALDH1A1LMNASMN1; SMN2HSD17B10HTT | |
| SCHEMBL4607629 | 0.82 | KDM4E (0.52) | ALDH1A1LMNACYP2C9CYP2C19SMN1; SMN2 | |
| SCHEMBL4606968 | 0.80 | ADRB3 (0.42) | LMNAHSD17B10ADRB2ADRB1ADRB3 | |
| SCHEMBL4605749 | 0.80 | TLR9 (0.49) | ALDH1A1LMNACYP2C19SMN1; SMN2GAA | |
| SCHEMBL4608590 | 0.80 | RAB9A (0.46) | ALDH1A1LMNACYP2D6CYP2C9CYP2C19 | |
| SCHEMBL2994138 | 0.79 | ADRB2 (0.60) | KCNA5ADRB2ADRB1ADRB3 | |
| SCHEMBL4605834 | 0.79 | CYP1A2 (0.44) | ALDH1A1CYP2D6CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL4607479 | 0.79 | PTK2 (0.45) | ADRB2ADRB1ADRB3 | |
| SCHEMBL4605132 | 0.78 | ADRB3 (0.46) | GAAADRB2ADRB1ADRB3 | |
| SCHEMBL4608251 | 0.78 | MITF (0.43) | ALDH1A1L3MBTL1PKMADRB3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1945612-A2 | HETEROCYCLIC COMPOUNDS AS PSTAT3/IL-6 INHIBITORS | Orchid Research Laboratories Limited (IN) | 2008-07-23 | — | — | EP | claimed |
| WO-2007042912-A2 | HETEROCYCLIC COMPOUNDS AS PSTAT3/IL-6 INHIBITORS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-04-19 | — | — | WO | claimed |