Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7969063 | 0.89 | CYP2D6 (0.42) | KMT2AALDH1A1POLBGAA | |
| SCHEMBL7938408 | 0.86 | CYP2C9 (0.43) | KMT2AALDH1A1TDP1POLBGAA | |
| SCHEMBL7951892 | 0.85 | POLB (0.39) | ALDH1A1NPC1POLBHTT | |
| SCHEMBL7944071 | 0.83 | HTT (0.40) | ALDH1A1NPC1MTNR1AMTNR1BPOLB | |
| SCHEMBL7948016 | 0.83 | POLB (0.38) | KMT2AALDH1A1NPC1ATMSMN1; SMN2 | |
| SCHEMBL7945520 | 0.82 | NPC1 (0.39) | KMT2AALDH1A1NPC1SMN1; SMN2MTNR1A | |
| SCHEMBL7982206 | 0.82 | POLB (0.36) | KMT2AALDH1A1NPC1NQO2MTNR1A | |
| SCHEMBL7947094 | 0.81 | POLB (0.37) | KMT2AALDH1A1NPC1ATMSMN1; SMN2 | |
| SCHEMBL7946743 | 0.81 | MITF (0.45) | KMT2AALDH1A1NPC1ATMSMN1; SMN2 | |
| SCHEMBL7951886 | 0.81 | MITF (0.45) | KMT2AALDH1A1NPC1ATMSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010035032-A1 | CALCIUM ION CHANNEL MODULATORS & USES THEREOF | LECTUS THERAPEUTICS LIMITED (GB) | 2010-04-01 | — | — | WO | disclosed |
| WO-2009133387-A1 | INDOLE- 3 -GLYOXYLAMIDE DERIVATIVES FOR USE AS CALCIUM ION CHANNEL MODULATORS | LECTUS THERAPEUTICS LIMITED (GB) | 2009-11-05 | — | — | WO | disclosed |