Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 5/20 | 0.36 |
| ▸ | CPN1 | P15169 | 2/20 | 0.35 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CCR3 | P51677 | 1/20 | 0.34 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.33 |
| ▸ | PPIB | P23284 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.32 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.32 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.32 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8918034 | 0.80 | F2 (0.38) | PDK1ALDH1A1USP2SMN1; SMN2TSHR | |
| SCHEMBL21813316 | 0.75 | ACKR3 (0.51) | KDM4EALDH1A1ACKR3TSHR | |
| Hydrochloric Acid SCHEMBL7396008 | 0.74 | PDK1 (0.41) | PDK1CPN1CPB2LMNA | |
| Trifluoroacetic Acid SCHEMBL7293334 | 0.74 | DPP8 (0.34) | PDK1CPN1CPB2 | |
| SCHEMBL1542957 | 0.72 | F2 (0.48) | CPN1CPB2KDM4EALDH1A1TPSAB1 | |
| SCHEMBL28629541 | 0.72 | KDM4E (0.41) | PDK1KDM4EALDH1A1ACKR3LMNA | |
| SCHEMBL28629542 | 0.72 | KDM4E (0.41) | PDK1KDM4EALDH1A1ACKR3LMNA | |
| SCHEMBL20752420 | 0.71 | PDK1 (0.58) | PDK1CPN1CPB2LMNA | |
| SCHEMBL24158828 | 0.71 | PDK1 (0.63) | PDK1 | |
| SCHEMBL8575864 | 0.71 | PDK1 (0.38) | PDK1 |
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-0559046-B1 | N-amidinopiperidinyl(3/4)- or N-amidino-1,4-Oxazinyl(2)-substituted sulfonamides, process for their preparation and use as thrombin inhibitors | HOFFMANN LA ROCHE (CH) | 2001-07-11 | — | — | EP | disclosed |
| EP-0559046-A1 | N-amidinopiperidinyl(3/4)- or N-amidino-1,4-Oxazinyl(2)-substituted sulfonamides, process for their preparation and use as thrombin inhibitors | F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) | 1993-09-08 | — | — | EP | disclosed |