Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 6/20 | 0.46 |
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | ACP1 | P24666 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL7379857 | 0.84 | HDAC6 (0.44) | PPARGRAB9ANPC1HDAC6ALDH1A1 | |
| SCHEMBL6634815 | 0.74 | NPC1 (0.52) | RAB9ANPC1HDAC6ALDH1A1LMNA | |
| SCHEMBL7383468 | 0.73 | RAB9A (0.58) | PPARGRAB9ANPC1HDAC6ALDH1A1 | |
| SCHEMBL7377767 | 0.72 | ALDH1A1 (0.53) | PPARGRAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL6635646 | 0.71 | PPARG (0.43) | PPARGNPC1HDAC6ALDH1A1USP2 | |
| SCHEMBL6636883 | 0.70 | SMN1; SMN2 (0.56) | PPARGRAB9ANPC1HDAC6ALDH1A1 | |
| SCHEMBL6638614 | 0.70 | F2 (0.43) | PPARGRAB9ANPC1HDAC6ALDH1A1 | |
| SCHEMBL6781977 | 0.70 | BRPF1 (0.48) | PPARGRAB9ANPC1HDAC6ALDH1A1 | |
| SCHEMBL14451616 | 0.70 | RAB9A (0.72) | RAB9ANPC1TP53SMN1; SMN2MAPT | |
| SCHEMBL5901016 | 0.69 | GAA (0.65) | RAB9AALDH1A1LMNATP53SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000050419-A1 | SUBSTITUTED BICYCLIC HETEROCYCLES AND THE USE THEREOF AS THROMBIN INHIBITORS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2000-08-31 | — | — | WO | disclosed |