Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 5/20 | 0.50 |
| ▸ | CTSS | P25774 | 5/20 | 0.50 |
| ▸ | CTSK | P43235 | 5/20 | 0.50 |
| ▸ | GRN | P28799 | 2/20 | 0.50 |
| ▸ | SORT1 | Q99523 | 2/20 | 0.50 |
| ▸ | CTSB | P07858 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | MMP7 | P09237 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.45 |
| ▸ | MME | P08473 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | FABP4 | P15090 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7448284 | 0.77 | ITGB1 (0.49) | CTSSCTSKCTSBMMP2MMP9 | |
| SCHEMBL31163587 | 0.75 | MME (0.54) | GRNSORT1MMEALDH1A1MEN1 | |
| SCHEMBL7062306 | 0.73 | MMP2 (0.69) | GRNSORT1KDM4EMMP1MMP2 | |
| SCHEMBL8840147 | 0.73 | MMP2 (0.69) | GRNSORT1KDM4EMMP1MMP2 | |
| SCHEMBL7442952 | 0.71 | ITGB1 (0.53) | CTSLCTSSCTSKCTSBMMP2 | |
| SCHEMBL30916038 | 0.71 | MME (0.55) | MMP2MMP9MMEALDH1A1MEN1 | |
| SCHEMBL7065982 | 0.70 | RAB9A (0.67) | GRNSORT1KDM4EMMP1MMP2 | |
| SCHEMBL4371232 | 0.70 | MMP2 (0.63) | MMP1MMP2MMP3MMP7MMP9 | |
| SCHEMBL7099492 | 0.70 | MMP2 (0.63) | MMP1MMP2MMP3MMP7MMP9 | |
| SCHEMBL7448892 | 0.70 | MMP2 (0.53) | CTSLCTSSCTSKCTSBMMP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0998282-A4 | SULFONAMIDES AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2000-08-30 | — | — | EP | claimed |
| EP-0998282-A1 | SULFONAMIDES AS CELL ADHESION INHIBITORS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2000-05-10 | — | — | EP | claimed |
| WO-1998053818-A1 | SULFONAMIDES AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1998-12-03 | — | — | WO | claimed |