Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | PADI4 | Q9UM07 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | CRHBP | P24387 | 2/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9738879 | 0.79 | KDM4E (0.51) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL6651492 | 0.76 | ALDH1A1 (0.39) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL6626014 | 0.74 | KDM4E (0.38) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL10764117 | 0.74 | KDM4E (0.47) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL10698893 | 0.74 | KDM4E (0.47) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL10433439 | 0.73 | GAA (0.47) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| Hydrochloric Acid SCHEMBL10765883 | 0.73 | KDM4E (0.46) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL10515890 | 0.71 | HTR2A (0.51) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL6831687 | 0.71 | HRH4 (0.41) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL10514839 | 0.70 | HTR2A (0.55) | KDM4EALDH1A1HPGDTSHRHSD17B10 |
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-1305048-A2 | INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES | Wockhardt Limited (IN) | 2003-05-02 | — | — | EP | disclosed |
| WO-2002009758-A2 | INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES | WOCKHARDT LIMITED (IN) | 2002-02-07 | — | — | WO | disclosed |