Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5555082 | 0.83 | HDAC1 (0.46) | CTSK | |
| SCHEMBL9053388 | 0.69 | NPC1 (0.56) | HSD17B10KDM4EALDH1A1ALOX15NPC1 | |
| SCHEMBL6440706 | 0.68 | HPGD (0.54) | HSD17B10NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL7545282 | 0.67 | SMN1; SMN2 (0.51) | HSD17B10ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7552785 | 0.66 | SMN1; SMN2 (0.49) | HSD17B10ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10352587 | 0.66 | TSHR (0.57) | HSD17B10KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL8507123 | 0.66 | HPGD (0.67) | HSD17B10ALDH1A1RAB9AMEN1KMT2A | |
| SCHEMBL8282497 | 0.65 | NPC1 (0.57) | ALDH1A1ALOX15NPC1RAB9AMEN1 | |
| SCHEMBL30890579 | 0.65 | HPGD (0.65) | HSD17B10ALDH1A1RAB9AMEN1KMT2A | |
| SCHEMBL5555071 | 0.64 | HDAC4 (0.49) | CTSK |
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-1784194-A1 | HISTONE DEACETYLASE INHIBITORS | Merck & Co., Inc. (US) | 2007-05-16 | — | — | EP | disclosed |
| WO-2006026260-A1 | HISTONE DEACETYLASE INHIBITORS | MERCK & CO., INC. (US) | 2006-03-09 | — | — | WO | disclosed |