Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | KCNK3 | O14649 | 4/20 | 0.55 |
| ▸ | KCNK9 | Q9NPC2 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | GRM5 | P41594 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | ITK | Q08881 | 1/20 | 0.50 |
| ▸ | IDE | P14735 | 1/20 | 0.50 |
| ▸ | HPGDS | O60760 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7347368 | 0.83 | HPGDS (0.46) | KMT2AMEN1NPC1RAB9AHPGDS | |
| SCHEMBL11783362 | 0.82 | RAB9A (0.55) | NPC1RAB9AHDAC6POLBTP53 | |
| SCHEMBL6825870 | 0.82 | NPC1 (0.54) | KMT2AMEN1NPC1RAB9AHDAC6 | |
| SCHEMBL18912321 | 0.80 | LOXL2 (0.47) | HPGDS | |
| SCHEMBL15305704 | 0.77 | KMT2A (0.65) | NT5EKMT2AKCNK3KCNK9MEN1 | |
| SCHEMBL11783568 | 0.77 | HPGDS (0.58) | KMT2AMEN1NPC1RAB9ATP53 | |
| SCHEMBL18671007 | 0.77 | PTGES (0.53) | KMT2ANPC1RAB9AADORA3HPGDS | |
| SCHEMBL12892190 | 0.77 | NT5E (0.57) | NT5EKMT2AKCNK3KCNK9MEN1 | |
| SCHEMBL3891452 | 0.77 | HPGDS (0.48) | KMT2AMEN1NPC1RAB9AHPGDS | |
| SCHEMBL11780084 | 0.77 | LMNA (0.58) | KMT2AKCNK3MEN1NPC1RAB9A |
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-0815108-A1 | CYCLIC UREA HIV PROTEASE INHIBITORS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-01-07 | — | — | EP | claimed |
| US-5683999-A | Cyclic urea HIV protease inhibitors | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-11-04 | — | — | US | claimed |
| EP-0815108-A1 | CYCLIC UREA HIV PROTEASE INHIBITORS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-01-07 | — | — | EP | disclosed |
| US-5683999-A | Cyclic urea HIV protease inhibitors | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-11-04 | — | — | US | disclosed |