Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7543136 | 0.81 | MEN1 (0.36) | ALDH1A1KMT2AMEN1NPSR1 | |
| SCHEMBL7371580 | 0.79 | MEN1 (0.34) | ALDH1A1KMT2AMEN1NPSR1 | |
| SCHEMBL7371962 | 0.76 | DRD4 (0.34) | ALDH1A1KMT2AMEN1NPSR1 | |
| SCHEMBL7375487 | 0.76 | SLC18A3 (0.41) | CAPN1CTSBCTSSCTSKALDH1A1 | |
| SCHEMBL5871291 | 0.73 | NPC1 (0.39) | ALDH1A1 | |
| SCHEMBL27628961 | 0.70 | CYP2C19 (0.40) | ALDH1A1 | |
| SCHEMBL27733749 | 0.65 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL7542966 | 0.64 | MEN1 (0.57) | CAPN1KMT2AMEN1NPSR1ACE2 | |
| SCHEMBL9180507 | 0.64 | FABP7 (0.40) | CTSBCTSKALDH1A1 | |
| SCHEMBL9485689 | 0.63 | FABP7 (0.42) | ALDH1A1GAA |
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-1194152-A4 | SRC KINASE INHIBITOR COMPOUNDS | MERCK & CO INC (US) | 2002-11-06 | — | — | EP | disclosed |
| EP-1194152-A1 | SRC KINASE INHIBITOR COMPOUNDS | Merck & Co., Inc. (US) | 2002-04-10 | — | — | EP | disclosed |
| US-6316444-B1 | SRC kinase inhibitor compounds | MERCK & CO., INC. | 2001-11-13 | — | — | US | disclosed |
| WO-2001000214-A1 | SRC KINASE INHIBITOR COMPOUNDS | MERCK & CO., INC. (US) | 2001-01-04 | — | — | WO | disclosed |