Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | PTPRC | P08575 | 1/20 | 0.32 |
| ▸ | LDHA | P00338 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | GALR1 | P47211 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15520665 | 0.82 | CYP1A2 (0.34) | ALDH1A1HSD11B1NOTUMIDO1 | |
| SCHEMBL3990580 | 0.78 | CYP2A6 (0.44) | CYP2A6NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL6576709 | 0.77 | CYP2A6 (0.38) | CYP2A6NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL8560761 | 0.77 | CYP2A6 (0.43) | CYP2A6NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL9988583 | 0.72 | ALDH1A1 (0.46) | CYP2A6NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL10506626 | 0.72 | PLA2G7 (0.41) | CYP2A6NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL7458982 | 0.72 | CYP2A6 (0.59) | CYP2A6NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL9512604 | 0.71 | CYP2A6 (0.41) | CYP2A6NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL4313272 | 0.71 | NOTUM (0.39) | CYP2A6TSHRNOTUMIDO1P2RX7 | |
| SCHEMBL9729126 | 0.71 | CYP2A6 (0.41) | CYP2A6NPC1RAB9ASMN1; SMN2TP53 |
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-1615890-A1 | PIPERIDINE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION | WARNER-LAMBERT COMPANY (US) | 2006-01-18 | — | — | EP | disclosed |
| WO-2004089903-A1 | PIPERIDINE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION | WARNER-LAMBERT COMPANY LLC (US) | 2004-10-21 | — | — | WO | disclosed |