Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.51 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 3/20 | 0.51 |
| ▸ | DRD3 | P35462 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2997062 | 0.85 | ADRB2 (0.59) | TSHRSMN1; SMN2 | |
| SCHEMBL2992193 | 0.77 | ADRB3 (0.57) | HSD11B1LMNA | |
| SCHEMBL18917630 | 0.76 | KMT2A (0.52) | HSD17B10ALDH1A1KDM4EHPGDPARP1 | |
| SCHEMBL13149543 | 0.74 | ALDH1A1 (0.64) | HSD17B10TSHRGFERALDH1A1KDM4E | |
| SCHEMBL2165589 | 0.73 | DRD2 (0.52) | DRD2DRD3HSD17B10TSHRGFER | |
| SCHEMBL2998745 | 0.72 | ADRB2 (0.53) | ALDH1A1KDM4EHPGDCYP1A2CYP3A4 | |
| SCHEMBL2998748 | 0.72 | ADRB2 (0.53) | ALDH1A1KDM4EHPGDCYP1A2CYP3A4 | |
| SCHEMBL18029394 | 0.71 | ALDH1A1 (0.68) | DRD2DRD3HSD17B10TSHRGFER | |
| SCHEMBL9412168 | 0.71 | ALDH1A1 (0.63) | HSD17B10TSHRGFERALDH1A1KDM4E | |
| SCHEMBL2997254 | 0.70 | MEN1 (0.64) | TSHRKDM4ESMN1; SMN2HTTLMNA |
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 | disclosed |
| WO-2007042912-A2 | HETEROCYCLIC COMPOUNDS AS PSTAT3/IL-6 INHIBITORS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-04-19 | — | — | WO | disclosed |