Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.67 |
| ▸ | MAPT | P10636 | 5/20 | 0.67 |
| ▸ | RAB9A | P51151 | 5/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.49 |
| ▸ | CHRNB4 | P30926 | 5/20 | 0.49 |
| ▸ | CHRNA3 | P32297 | 5/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 3/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10880685 | 0.84 | NPC1 (0.64) | NPC1MAPTRAB9ASMN1; SMN2POLB | |
| SCHEMBL22192215 | 0.84 | NPC1 (0.86) | NPC1MAPTRAB9ASMN1; SMN2POLB | |
| SCHEMBL10877460 | 0.84 | SMN1; SMN2 (0.60) | NPC1MAPTRAB9ASMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10876746 | 0.84 | NPC1 (0.63) | NPC1MAPTRAB9ASMN1; SMN2POLB | |
| SCHEMBL10878167 | 0.79 | NPC1 (0.66) | NPC1MAPTRAB9ASMN1; SMN2POLB | |
| SCHEMBL10878361 | 0.79 | NPC1 (0.78) | NPC1MAPTRAB9ASMN1; SMN2POLB | |
| SCHEMBL7291413 | 0.78 | SMN1; SMN2 (0.76) | NPC1MAPTRAB9ASMN1; SMN2POLB | |
| SCHEMBL7302094 | 0.78 | SMN1; SMN2 (0.76) | NPC1MAPTRAB9ASMN1; SMN2POLB | |
| SCHEMBL10879495 | 0.78 | CYP2D6 (0.74) | NPC1MAPTRAB9ASMN1; SMN2POLB | |
| SCHEMBL8931482 | 0.77 | NPC1 (0.70) | NPC1MAPTRAB9ASMN1; SMN2POLB |
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-0100051-B1 | NEW DERIVATIVES OF 1-ALKYLAMINE-(4(P-ALKYLOXY-BENZAMIDE)PHENOXY)-2-PROPANOL, HAVING BETA-SYMPATHOLYTIC ACTIVITY, THEIR SALTS, AND PRODUCTION PROCESSES THEREOF | A. Menarini S.a.S. (IT) | 1986-04-09 | — | — | EP | disclosed |