Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | KDM6B | O15054 | 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 | |
|---|---|---|---|---|
| SCHEMBL7077241 | 0.76 | CTNNB1 (0.51) | MAPK1NPC1MEN1KMT2APRSS1 | |
| SCHEMBL6949801 | 0.76 | L3MBTL1 (0.55) | LMNAMAPK1L3MBTL1CASP3SENP7 | |
| SCHEMBL6943712 | 0.73 | PRSS1 (0.46) | LMNAMAPK1L3MBTL1CASP3SENP7 | |
| SCHEMBL176214 | 0.72 | ALOX15 (0.55) | PSMB5LMNAL3MBTL1NPC1MEN1 | |
| SCHEMBL30746861 | 0.72 | ALOX15 (0.55) | PSMB5LMNAL3MBTL1NPC1MEN1 | |
| SCHEMBL27639484 | 0.72 | PRSS1 (0.45) | LMNAMAPK1L3MBTL1CASP3SENP7 | |
| SCHEMBL27347922 | 0.72 | MAOB (0.57) | NPC1MEN1KMT2ACYP2C19 | |
| SCHEMBL6492538 | 0.71 | PTPN1 (0.62) | LMNAPRSS1PRSS2PRSS3PTPN1 | |
| SCHEMBL2379457 | 0.71 | TRPA1 (0.62) | LMNAMAPK1PRSS1PRSS2PRSS3 | |
| Hydrochloric Acid SCHEMBL1280719 | 0.71 | ALOX15 (0.53) | PSMB5LMNAL3MBTL1NPC1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1082121-A4 | HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2003-02-05 | — | — | EP | disclosed |
| US-6380249-B1 | HIV integrase inhibitors | MERCK & CO., INC. | 2002-04-30 | — | — | US | disclosed |
| EP-1082121-A1 | HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2001-03-14 | — | — | EP | disclosed |
| WO-1999062520-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 1999-12-09 | — | — | WO | disclosed |