Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.46 |
| ▸ | CTSS | P25774 | 2/20 | 0.46 |
| ▸ | CTSK | P43235 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TPSAB1 | Q15661 | 3/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.37 |
| ▸ | TGM2 | P21980 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP12 | P39900 | 1/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7315575 | 1.00 | CTSL (0.46) | CTSLCTSSCTSKIDO1TDO2 | |
| SCHEMBL7518938 | 0.88 | IDO1 (0.40) | CTSLCTSSCTSKIDO1TDO2 | |
| SCHEMBL7518951 | 0.88 | IDO1 (0.40) | CTSLCTSSCTSKIDO1TDO2 | |
| SCHEMBL7518931 | 0.88 | IDO1 (0.40) | CTSLCTSSCTSKIDO1TDO2 | |
| SCHEMBL7384402 | 0.85 | IDO1 (0.43) | IDO1TDO2HTTTPSAB1KEAP1 | |
| SCHEMBL7384409 | 0.85 | IDO1 (0.43) | IDO1TDO2HTTTPSAB1KEAP1 | |
| SCHEMBL7413013 | 0.85 | IDO1 (0.43) | IDO1TDO2HTTTPSAB1KEAP1 | |
| SCHEMBL7412445 | 0.85 | IDO1 (0.43) | IDO1TDO2HTTTPSAB1KEAP1 | |
| SCHEMBL7412431 | 0.85 | IDO1 (0.43) | IDO1TDO2HTTTPSAB1KEAP1 | |
| SCHEMBL7412436 | 0.85 | IDO1 (0.43) | IDO1TDO2HTTTPSAB1KEAP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5326863-A | Antithrombin and antitrypsin activity | BRISTOL-MYERS SQUIBB COMPANY (US) | 1994-07-05 | — | — | US | disclosed |
| US-5250677-A | Anticoagulants | BRISTOL-MYERS SQUIBB COMPANY (US) | 1993-10-05 | — | — | US | disclosed |
| US-5175283-A | Enzyme inhibitors for antitrypsin or antithrombin as anticoagulants | BRISTOL-MYERS SQUIBB COMPANY (US) | 1992-12-29 | — | — | US | disclosed |
| US-5110812-A | Treatment of pancreatitis; anticoagulants | BRISTOL-MYERS SQUIBB CO. (US) | 1992-05-05 | — | — | US | disclosed |
| US-5037819-A | Anticoagulant; treating pancreatitis | BRISTOL-MYERS SQUIBB COMPANY (US) | 1991-08-06 | — | — | US | disclosed |