Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.38 |
| ▸ | KLK7 | P49862 | 1/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | RHEB | Q15382 | 1/20 | 0.35 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10463619 | 0.76 | NPSR1 (0.50) | NPSR1L3MBTL1KDM4EERCC1FEN1 | |
| SCHEMBL12844759 | 0.74 | KLK7 (0.40) | NPSR1L3MBTL1KDM4EERCC1FEN1 | |
| SCHEMBL9482238 | 0.73 | NPSR1 (0.47) | NPSR1KDM4EERCC1FEN1ERCC4 | |
| SCHEMBL14692634 | 0.71 | PTGS1 (0.54) | — | |
| SCHEMBL14799969 | 0.69 | PIN1 (0.51) | L3MBTL1KDM4EERCC1FEN1ERCC4 | |
| SCHEMBL9031781 | 0.68 | CSNK2A2 (0.41) | KDM4EKLK7ALDH1A1RAB9AMAPT | |
| SCHEMBL9031779 | 0.68 | CSNK2A2 (0.41) | KDM4EKLK7KDM4CALDH1A1RAB9A | |
| SCHEMBL13174730 | 0.67 | ERCC1 (0.70) | L3MBTL1KDM4EERCC1FEN1ERCC4 | |
| SCHEMBL10333608 | 0.67 | HSD17B10 (0.46) | KLK7HTTALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL8951086 | 0.67 | NPSR1 (1.00) | NPSR1L3MBTL1KDM4EKDM4CALDH1A1 |
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-2005011609-A2 | TRIAZOLOPURINE-BASED TRICYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-02-10 | — | — | WO | disclosed |
| WO-2004075846-A2 | PYRAZOLOPURINE-BASED TRICYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-09-10 | — | — | WO | disclosed |