Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 12/20 | 0.36 |
| ▸ | CA2 | P00918 | 12/20 | 0.36 |
| ▸ | CA4 | P22748 | 12/20 | 0.36 |
| ▸ | CA9 | Q16790 | 12/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3495460 | 0.87 | CA1 (0.40) | ALDH1A1NOTUMSMN1; SMN2NPC1RAB9A | |
| SCHEMBL3492063 | 0.87 | ALDH1A1 (0.41) | ALDH1A1NOTUMSMN1; SMN2NPC1RAB9A | |
| SCHEMBL3493355 | 0.85 | CA1 (0.44) | CA1CA2CA4CA9 | |
| SCHEMBL3495346 | 0.84 | SMN1; SMN2 (0.41) | ALDH1A1NOTUMSMN1; SMN2NPC1RAB9A | |
| SCHEMBL3493841 | 0.84 | ALDH1A1 (0.39) | ALDH1A1NOTUMSMN1; SMN2NPC1RAB9A | |
| SCHEMBL3494880 | 0.84 | CA1 (0.41) | CA1CA2CA4CA9 | |
| SCHEMBL3494368 | 0.84 | CA1 (0.41) | CA1CA2CA4CA9 | |
| SCHEMBL3493449 | 0.83 | SMN1; SMN2 (0.42) | ALDH1A1NOTUMSMN1; SMN2NPC1RAB9A | |
| SCHEMBL3493665 | 0.83 | BCL2 (0.38) | ALDH1A1NOTUMSMN1; SMN2NPC1RAB9A | |
| SCHEMBL4982310 | 0.82 | ALDH1A1 (0.37) | ALDH1A1NOTUMSMN1; SMN2MAPTLMNA |
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-1984355-A2 | CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION | Takeda Pharmaceutical Company Limited (JP) | 2008-10-29 | — | — | EP | disclosed |
| WO-2007094513-A2 | CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-08-23 | — | — | WO | disclosed |