Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | FURIN | P09958 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9486121 | 0.89 | TP53 (0.50) | ALDH1A1POLBCASP3HDAC1HDAC2 | |
| SCHEMBL9487413 | 0.86 | CYP1A2 (0.61) | ALDH1A1POLBCASP3HDAC1HDAC2 | |
| SCHEMBL7366105 | 0.83 | THRA (0.63) | ALDH1A1POLBMEN1KMT2AGAA | |
| SCHEMBL17372495 | 0.82 | ALDH1A1 (0.72) | ALDH1A1POLBCASP3HDAC1HDAC2 | |
| SCHEMBL9845422 | 0.82 | CYP1A1 (0.62) | ALDH1A1POLBCASP3HDAC1HDAC2 | |
| SCHEMBL9320361 | 0.82 | NPC1 (0.61) | ALDH1A1CASP3MEN1KMT2AMAPT | |
| SCHEMBL18048654 | 0.81 | KMT2A (0.63) | ALDH1A1POLBHDAC1HDAC2HDAC6 | |
| SCHEMBL6404247 | 0.80 | HDAC4 (0.66) | HDAC1HDAC2HDAC6L3MBTL1CYP2C9 | |
| Hydrochloric Acid SCHEMBL7806547 | 0.79 | HDAC4 (0.64) | HDAC1HDAC2HDAC6L3MBTL1CYP2C9 | |
| SCHEMBL7307465 | 0.79 | HDAC1 (0.73) | ALDH1A1POLBHDAC1HDAC2HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5223510-A | ALKYLAMINOALKYL DERIVATIVES OF BENZOFURAN, BENZOTHIOPHENE, INDOLE AND INDOLIZINE, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM | SANOFI (FR) | 1993-06-29 | — | — | US | disclosed |