Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CKS1B | P61024 | 2/20 | 0.45 |
| ▸ | SKP1 | P63208 | 2/20 | 0.45 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | ATR | Q13535 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6802903 | 0.77 | CTSK (0.53) | MEN1KMT2AALDH1A1CTSSCTSK | |
| SCHEMBL4583816 | 0.76 | MEN1 (0.54) | IDO1MALT1NPSR1MEN1KMT2A | |
| SCHEMBL6335913 | 0.76 | CKS1B (0.43) | CKS1BSKP1SKP2S1PR1ATR | |
| SCHEMBL29182105 | 0.74 | MEN1 (0.49) | CKS1BSKP1SKP2S1PR1IDO1 | |
| SCHEMBL7049753 | 0.74 | BCHE (0.41) | S1PR1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL20014854 | 0.72 | MTNR1A (0.61) | IDO1MALT1MEN1KMT2ACTSS | |
| SCHEMBL6676845 | 0.71 | CYP1A2 (0.43) | CKS1BSKP1SKP2IDO1MALT1 | |
| SCHEMBL14148637 | 0.70 | KDR (0.53) | CKS1BSKP1SKP2SMN1; SMN2MAPT | |
| SCHEMBL16084764 | 0.70 | RIPK1 (0.53) | IDO1MALT1MEN1KMT2ABCHE | |
| SCHEMBL1521024 | 0.70 | RIPK1 (0.53) | IDO1MALT1MEN1KMT2ABCHE |
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-1159273-A1 | COMPOUNDS USEFUL AS REVERSIBLE INHIBITORS OF CATHEPSIN S | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2001-12-05 | — | — | EP | disclosed |
| WO-2000051998-A1 | COMPOUNDS USEFUL AS REVERSIBLE INHIBITORS OF CATHEPSIN S | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2000-09-08 | — | — | WO | disclosed |