Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8911420 | 0.80 | ALDH1A1 (0.62) | ALDH1A1NPSR1MEN1KMT2AMAPT | |
| SCHEMBL5780179 | 0.79 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2ALMNAMAPT | |
| SCHEMBL8701374 | 0.78 | TP53 (0.59) | ALDH1A1MEN1KMT2ALMNAMAPT | |
| SCHEMBL3142532 | 0.78 | CYP11B2 (0.68) | ALDH1A1NPSR1MEN1KMT2ALMNA | |
| SCHEMBL5252325 | 0.78 | TP53 (0.48) | ALDH1A1KMT2ALMNAMAPTSMN1; SMN2 | |
| SCHEMBL27515192 | 0.76 | MAPT (0.54) | ALDH1A1LMNAMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL3758346 | 0.76 | RAB9A (0.49) | ALDH1A1NPSR1KMT2ALMNAMAPT | |
| SCHEMBL289623 | 0.72 | — | — | |
| SCHEMBL20314427 | 0.72 | CYP11B1 (0.55) | ALDH1A1NPSR1MEN1KMT2AMAPT | |
| SCHEMBL10607 | 0.72 | — | — |
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-1051394-A1 | POTASSIUM CHANNEL INHIBITORS | Icagen, Inc. (US) | 2000-11-15 | — | — | EP | disclosed |
| WO-1999037607-A1 | POTASSIUM CHANNEL INHIBITORS | ICAGEN, INC. (US) | 1999-07-29 | — | — | WO | disclosed |