Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 5/20 | 0.42 |
| ▸ | MPO | P05164 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | LTB4R | Q15722 | 6/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL88995 | 0.87 | TSHR (0.45) | TSHRNCF1MPOHTTCTDSP1 | |
| SCHEMBL28416153 | 0.81 | NCF1 (0.50) | TSHRNCF1MPOHTTCTDSP1 | |
| SCHEMBL8264291 | 0.79 | LTB4R (0.49) | NCF1HTTCTDSP1LTB4RKDM4E | |
| Hydrochloric Acid SCHEMBL28059935 | 0.79 | NCF1 (0.49) | TSHRNCF1MPOHTTCTDSP1 | |
| SCHEMBL88950 | 0.79 | KDM4E (0.46) | NCF1HTTCTDSP1LTB4RKDM4E | |
| SCHEMBL1911257 | 0.78 | NCF1 (0.43) | NCF1HTTCTDSP1LTB4RKDM4E | |
| SCHEMBL13490840 | 0.78 | LTB4R (0.44) | NCF1MPOHTTCTDSP1LTB4R | |
| SCHEMBL88934 | 0.78 | HTR3E (0.43) | TSHRNCF1HTTCTDSP1KDM4E | |
| SCHEMBL8265068 | 0.76 | LTB4R (0.41) | NCF1HTTCTDSP1LTB4RKDM4E | |
| SCHEMBL8564988 | 0.75 | LTB4R (0.45) | TSHRHTTLTB4RALDH1A1LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2420491-B1 | 3 , 5-SUBSTITUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS | NOVARTIS AG (CH) | 2013-07-03 | — | — | EP | disclosed |