Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.66 |
| ▸ | LMNA | P02545 | 6/20 | 0.62 |
| ▸ | GAA | P10253 | 4/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | MAOA | P21397 | 2/20 | 0.60 |
| ▸ | MAOB | P27338 | 2/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL17595823 | 0.84 | LMNA (0.79) | KMT2ALMNAGAARAB9AMAOA | |
| SCHEMBL8956279 | 0.83 | KMT2A (0.78) | KMT2ALMNAGAARAB9AMAOA | |
| SCHEMBL11438307 | 0.83 | KMT2A (0.77) | KMT2ALMNAGAARAB9AMAOA | |
| SCHEMBL4575974 | 0.82 | LMNA (0.87) | KMT2ALMNAGAARAB9AMAOA | |
| SCHEMBL10667599 | 0.81 | KMT2A (0.75) | KMT2ALMNAGAARAB9AMAOA | |
| SCHEMBL3013357 | 0.81 | KMT2A (0.64) | KMT2ALMNAGAARAB9AMAOA | |
| SCHEMBL5445981 | 0.81 | KMT2A (0.75) | KMT2ALMNAGAARAB9AMAOA | |
| SCHEMBL5447975 | 0.81 | KMT2A (0.75) | KMT2ALMNAGAARAB9AMAOA | |
| SCHEMBL11068116 | 0.81 | KMT2A (0.75) | KMT2ALMNAGAARAB9AMAOA | |
| SCHEMBL5446742 | 0.81 | KMT2A (0.75) | KMT2ALMNAGAARAB9AMAOA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6503898-B1 | Administering 4,7-dibenzyl-5,6-dihydroxy-N,N*-di(m-aminobenzyl)--1,3-diazepin-2-one or salt to treat human immunodeficiency virus infection | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2003-01-07 | — | — | US | disclosed |