Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.66 |
| ▸ | RAB9A | P51151 | 6/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.66 |
| ▸ | TP53 | P04637 | 4/20 | 0.66 |
| ▸ | POLB | P06746 | 2/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | MAPT | P10636 | 5/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 5/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.57 |
| ▸ | CASP2 | P42575 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | SCD | O00767 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL4405589 | 0.90 | NPC1 (0.63) | NPC1RAB9ASMN1; SMN2TP53POLB | |
| SCHEMBL5158057 | 0.86 | DYRK1A (0.65) | NPC1RAB9ASMN1; SMN2TP53POLB | |
| SCHEMBL4399574 | 0.83 | SMN1; SMN2 (0.55) | NPC1RAB9ASMN1; SMN2TP53POLB | |
| SCHEMBL4396844 | 0.83 | SMN1; SMN2 (0.55) | NPC1RAB9ASMN1; SMN2TP53POLB | |
| Hydrochloric Acid SCHEMBL4398837 | 0.82 | SMN1; SMN2 (0.54) | NPC1RAB9ASMN1; SMN2TP53POLB | |
| SCHEMBL4396993 | 0.80 | ALDH1A1 (0.55) | NPC1RAB9ASMN1; SMN2TP53POLB | |
| SCHEMBL5186173 | 0.80 | MAPT (0.52) | NPC1RAB9ASMN1; SMN2POLBALDH1A1 | |
| SCHEMBL9332424 | 0.79 | SMN1; SMN2 (1.00) | NPC1RAB9ASMN1; SMN2TP53POLB | |
| SCHEMBL4399543 | 0.78 | RAB9A (0.66) | NPC1RAB9ASMN1; SMN2TP53POLB | |
| SCHEMBL5154663 | 0.78 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2ALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1745044-A2 | BENZOTHIAZOLE DERIVATIVES HAVING CDK MODULATING ACTIVITY AND USE THEREOF AS ANTICANCER AGENTS | Aventis Pharma S.A. (FR) | 2007-01-24 | — | — | EP | disclosed |
| WO-2005097787-A2 | NOVEL BENZOTHIAZOLES AND THE USE THEREOF AS MEDICAMENTS | AVENTIS PHARMA S.A. (FR) | 2005-10-20 | — | — | WO | disclosed |