Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 5/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29517920 | 0.73 | HPRT1 (0.67) | HPRT1ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL4847084 | 0.73 | HPRT1 (0.67) | HPRT1ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL3341788 | 0.73 | HPRT1 (0.67) | HPRT1ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL29481017 | 0.73 | ALDH1A1 (0.50) | HPRT1ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL54652 | 0.73 | ALDH1A1 (0.50) | HPRT1ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL6687309 | 0.72 | ALDH1A1 (0.44) | ALDH1A1HSD17B10TSHRTDP1CYP2A6 | |
| SCHEMBL7345934 | 0.72 | HPRT1 (0.58) | HPRT1ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL1038972 | 0.71 | HPRT1 (0.72) | HPRT1ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL30892665 | 0.71 | HPRT1 (0.72) | HPRT1ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL297902 | 0.71 | HPRT1 (0.72) | HPRT1ALDH1A1HSD17B10TSHRTDP1 |
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-2152670-A1 | BRIDGED SIX-MEMBERED RING COMPOUNDS | Actelion Pharmaceuticals Ltd. (CH) | 2010-02-17 | — | — | EP | disclosed |
| WO-2008132679-A1 | BRIDGED SIX-MEMBERED RING COMPOUNDS | ACTELION PHARMACEUTICALS LTD (CH) | 2008-11-06 | — | — | WO | disclosed |