Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3919655 | 0.90 | HDAC3 (0.50) | KMT2ACES2CES1CYP2C19LMNA | |
| SCHEMBL27257892 | 0.81 | KMT2A (0.47) | KMT2ACES2CES1LMNANPC1 | |
| Hydrochloric Acid SCHEMBL15566975 | 0.80 | KMT2A (0.50) | KMT2ACES2CES1CDK1CCNB1 | |
| SCHEMBL716489 | 0.79 | CES2 (0.50) | KMT2ACES2CES1LMNANPC1 | |
| SCHEMBL10637551 | 0.79 | KMT2A (0.55) | KMT2ALMNAALDH1A1 | |
| SCHEMBL4608676 | 0.78 | PPIA (0.50) | CES2CES1CYP2C19LMNANPC1 | |
| SCHEMBL31582828 | 0.78 | KMT2A (0.50) | KMT2ACES2CES1CYP2C19LMNA | |
| SCHEMBL29990216 | 0.77 | CES2 (0.52) | KMT2ACES2CES1LMNANPC1 | |
| SCHEMBL4006843 | 0.77 | CES2 (0.52) | KMT2ACES2CES1LMNANPC1 | |
| SCHEMBL27951327 | 0.76 | GAA (0.49) | KMT2ACES2CES1CYP2C19LMNA |
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-2021127333-A1 | TRPML MODULATORS | CASMA THERAPEUTICS, INC. (US) | 2021-06-24 | — | — | WO | disclosed |
| WO-2021127333-A1 | TRPML MODULATORS | CASMA THERAPEUTICS, INC. (US) | 2021-06-24 | — | — | WO | disclosed |