Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CHKA | P35790 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19334004 | 0.82 | ALDH1A1 (0.48) | KMT2AL3MBTL1HPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL7059653 | 0.75 | CHKA (0.44) | KMT2AMEN1CHKACNR1CNR2 | |
| SCHEMBL2777994 | 0.74 | HIF1A (0.62) | KMT2AMEN1SMN1; SMN2ALDH1A1CYP3A4 | |
| SCHEMBL2777991 | 0.74 | HIF1A (0.62) | KMT2AMEN1SMN1; SMN2ALDH1A1CYP3A4 | |
| SCHEMBL11390018 | 0.73 | CHKA (0.44) | KMT2AMEN1CHKACNR1CNR2 | |
| SCHEMBL5800607 | 0.73 | ACACB (0.44) | KMT2AHPGDPTGS1NFKB1LMNA | |
| SCHEMBL106905 | 0.73 | TAAR1 (0.52) | SMN1; SMN2MAPT | |
| Hydrochloric Acid SCHEMBL6770819 | 0.72 | HIF1A (0.61) | KMT2AMEN1SMN1; SMN2ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL6770816 | 0.72 | HIF1A (0.61) | KMT2AMEN1SMN1; SMN2ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL6770813 | 0.72 | HIF1A (0.61) | KMT2AMEN1SMN1; SMN2ALDH1A1CYP3A4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1015441-B1 | PROCESS TO PRODUCE 4-HYDROXY-2-OXO-PYRANE DERIVATIVES USEFUL AS PROTEASE INHIBITORS | UPJOHN CO (US) | 2004-05-12 | — | — | EP | disclosed |
| US-6265604-B1 | AS PROTEASE INHIBITOR USEFUL IN TREATING HUMANS INFECTED WITH THE HIV VIRUS | PHARMACIA & UPJOHN COMPANY | 2001-07-24 | — | — | US | disclosed |
| EP-1015441-A1 | PROCESS TO PRODUCE 4-HYDROXY-2-OXO-PYRANE DERIVATIVES USEFUL AS PROTEASE INHIBITORS | PHARMACIA & UPJOHN COMPANY (US) | 2000-07-05 | — | — | EP | disclosed |
| US-6077963-A | Process to produce a protease inhibitor | PHARMACIA & UPJOHN COMPANY (US) | 2000-06-20 | — | — | US | disclosed |
| WO-1999012919-A1 | PROCESS TO PRODUCE 4-HYDROXY-2-OXO-PYRANE DERIVATES USEFUL AS PROTEASE INHIBITORS | PHARMACIA & UPJOHN COMPANY (US) | 1999-03-18 | — | — | WO | disclosed |