Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3945345 | 0.98 | ALDH1A1 (0.42) | ALDH1A1KMT2ARAB9ANPC1POLB | |
| SCHEMBL3945898 | 0.93 | ALDH1A1 (0.51) | ALDH1A1KMT2ARAB9ANPC1POLB | |
| SCHEMBL3943864 | 0.90 | ALDH1A1 (0.38) | ALDH1A1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL4357051 | 0.90 | RAB9A (0.43) | ALDH1A1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL3942177 | 0.90 | MDM2 (0.43) | RAB9ANPC1MDM2 | |
| SCHEMBL3938881 | 0.90 | RAB9A (0.42) | ALDH1A1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL4032664 | 0.90 | RAB9A (0.42) | ALDH1A1RAB9ANPC1POLBMAPT | |
| SCHEMBL3944227 | 0.89 | DGAT1 (0.40) | ALDH1A1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL3939702 | 0.89 | RAB9A (0.42) | ALDH1A1KMT2ARAB9ANPC1POLB | |
| SCHEMBL3949749 | 0.88 | RAB9A (0.41) | ALDH1A1KMT2ARAB9ANPC1POLB |
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-2009019508-A1 | CALCIUM ION CHANNEL MODULATORS & USES THEREOF | LECTUS THERAPEUTICS LIMITED (GB) | 2009-02-12 | — | — | WO | claimed |
| WO-2009019508-A1 | CALCIUM ION CHANNEL MODULATORS & USES THEREOF | LECTUS THERAPEUTICS LIMITED (GB) | 2009-02-12 | — | — | WO | disclosed |