Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.49 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.49 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.39 |
| ▸ | AKT1 | P31749 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5362924 | 0.81 | KMT2A (0.41) | KMT2APOLBMEN1SMYD3AKT1 | |
| SCHEMBL5367918 | 0.80 | ALDH1A1 (0.41) | KMT2AMEN1MAPTSMYD3AKT1 | |
| SCHEMBL5366087 | 0.75 | HPGD (0.44) | KMT2APOLBMEN1MAPTSMYD3 | |
| SCHEMBL5370964 | 0.74 | KMT2A (0.46) | KMT2APOLBPPARGNCOA2NCOA1 | |
| SCHEMBL5371067 | 0.74 | NPC1 (0.42) | SMYD3AKT1CDK2NPC1RAB9A | |
| SCHEMBL5364811 | 0.73 | MEN1 (0.42) | KMT2AMEN1SMYD3AKT1CDK2 | |
| SCHEMBL5370713 | 0.72 | CTSL (0.42) | KMT2AMEN1SMYD3CTSL | |
| SCHEMBL5362898 | 0.72 | SMYD3 (0.43) | KMT2AMEN1MAPTSMYD3NPC1 | |
| SCHEMBL5366736 | 0.72 | AKT1 (0.42) | SMYD3AKT1NPC1RAB9A | |
| SCHEMBL5360331 | 0.71 | SCN3A (0.39) | SMYD3AKT1CDK2OPRD1 |
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-7259157-B2 | N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists | MERCK & CO., INC. (US) | 2007-08-21 | — | — | US | disclosed |