Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.73 |
| ▸ | MAPT | P10636 | 6/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.62 |
| ▸ | HPGD | P15428 | 2/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | TP53 | P04637 | 6/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL28436509 | 0.85 | NPC1 (1.00) | NPC1MAPTALDH1A1NPSR1KDM4E | |
| SCHEMBL759091 | 0.81 | NPC1 (0.77) | NPC1MAPTALDH1A1NPSR1KDM4E | |
| SCHEMBL10315955 | 0.80 | NPC1 (0.59) | NPC1MAPTALDH1A1NPSR1KDM4E | |
| SCHEMBL5832580 | 0.80 | NPC1 (0.79) | NPC1MAPTALDH1A1NPSR1KDM4E | |
| SCHEMBL12956189 | 0.80 | NPC1 (0.79) | NPC1MAPTALDH1A1NPSR1KDM4E | |
| SCHEMBL10271102 | 0.78 | NPC1 (0.57) | NPC1MAPTALDH1A1NPSR1KDM4E | |
| SCHEMBL1347677 | 0.78 | NPC1 (0.77) | NPC1MAPTALDH1A1NPSR1KDM4E | |
| SCHEMBL2688965 | 0.78 | NPC1 (0.60) | NPC1MAPTALDH1A1NPSR1KDM4E | |
| SCHEMBL5832479 | 0.78 | NPC1 (0.71) | NPC1MAPTALDH1A1NPSR1KDM4E | |
| SCHEMBL14019111 | 0.78 | NPC1 (0.71) | NPC1MAPTALDH1A1NPSR1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004067480-A2 | SUBSTITUTED PHENYLUREA DERIVATIVES AS HDAC INHIBITORS | OXFORD GLYCOSCIENCES (UK) LTD (GB) | 2004-08-12 | — | — | WO | disclosed |
| WO-2004067480-A2 | SUBSTITUTED PHENYLUREA DERIVATIVES AS HDAC INHIBITORS | OXFORD GLYCOSCIENCES (UK) LTD (GB) | 2004-08-12 | — | — | WO | disclosed |