Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 8/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8555646 | 0.86 | KMT2A (0.63) | RAB9AL3MBTL1KMT2AALDH1A1TP53 | |
| SCHEMBL7532358 | 0.82 | KMT2A (0.68) | RAB9AL3MBTL1KMT2AALDH1A1TP53 | |
| SCHEMBL29124508 | 0.78 | RAB9A (0.63) | RAB9AL3MBTL1KMT2AALDH1A1TP53 | |
| SCHEMBL30594478 | 0.78 | RAB9A (0.63) | RAB9AL3MBTL1KMT2AALDH1A1TP53 | |
| SCHEMBL1196054 | 0.77 | POLB (0.68) | RAB9AKMT2AALDH1A1TP53HPGD | |
| SCHEMBL7348632 | 0.75 | RAB9A (0.66) | RAB9AL3MBTL1KMT2AALDH1A1TP53 | |
| SCHEMBL8555107 | 0.75 | NPC1 (0.65) | RAB9AKMT2AALDH1A1HSD17B10NPC1 | |
| SCHEMBL30926777 | 0.74 | MEN1 (0.58) | RAB9AKMT2AALDH1A1NPC1HTT | |
| SCHEMBL27179677 | 0.74 | MEN1 (0.58) | RAB9AKMT2AALDH1A1NPC1HTT | |
| SCHEMBL14082266 | 0.74 | TRPV1 (0.60) | RAB9AL3MBTL1KMT2AALDH1A1NPC1 |
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 |