Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD2 | Q9HC29 | 4/20 | 0.64 |
| ▸ | NOD1 | Q9Y239 | 4/20 | 0.64 |
| ▸ | PPARG | P37231 | 9/20 | 0.54 |
| ▸ | PPARA | Q07869 | 7/20 | 0.54 |
| ▸ | PPARD | Q03181 | 5/20 | 0.54 |
| ▸ | BCL2 | P10415 | 1/20 | 0.42 |
| ▸ | BID | P55957 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | ACLY | P53396 | 2/20 | 0.40 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Benzenesulfonamide SCHEMBL8938299 | 0.93 | NOD2 (0.70) | NOD2NOD1PPARGPPARAPPARD | |
| SCHEMBL2347003 | 0.90 | NOD2 (0.78) | NOD2NOD1PPARGPPARAPPARD | |
| SCHEMBL8938381 | 0.85 | NOD2 (0.64) | NOD2NOD1PPARGPPARAPPARD | |
| SCHEMBL22003860 | 0.81 | NOD2 (0.69) | NOD2NOD1PPARGPPARAPPARD | |
| SCHEMBL16486105 | 0.79 | NOD2 (0.58) | NOD2NOD1PPARGPPARAPPARD | |
| SCHEMBL3141535 | 0.79 | NOD2 (0.69) | NOD2NOD1PPARGPPARAPPARD | |
| SCHEMBL2542152 | 0.78 | NOD2 (0.86) | NOD2NOD1BCL2BIDMCL1 | |
| SCHEMBL10003942 | 0.78 | NOD2 (0.78) | NOD2NOD1PPARGPPARAPPARD | |
| SCHEMBL13114472 | 0.76 | NOD2 (0.81) | NOD2NOD1PPARGPPARDBCL2 | |
| SCHEMBL3837213 | 0.75 | PPARG (0.61) | NOD2NOD1PPARGPPARAPPARD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5527819-A | TREATING AIDS | MERCK & CO., INC. (US) | 1996-06-18 | — | — | US | disclosed |
| EP-0686148-A4 | INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO INC (US) | 1996-02-07 | — | — | EP | disclosed |
| EP-0686148-A1 | INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO. INC. (US) | 1995-12-13 | — | — | EP | disclosed |
| WO-1994019321-A1 | INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO., INC. (US) | 1994-09-01 | — | — | WO | disclosed |