Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL21162717 | 0.79 | TEAD4 (0.50) | CYP2D6CYP2C9TEAD4ALDH1A1MAPT | |
| SCHEMBL21162718 | 0.77 | CYP2D6 (0.39) | CYP2D6CYP2C9TEAD4ALDH1A1MAPT | |
| SCHEMBL21163006 | 0.73 | TEAD4 (0.44) | CYP2D6CYP2C9TEAD4ALDH1A1MAPT | |
| SCHEMBL21162725 | 0.72 | FFAR1 (0.45) | ALDH1A1MAPTPOLBLMNAMEN1 | |
| SCHEMBL21162719 | 0.72 | FFAR1 (0.45) | ALDH1A1MAPTPOLBLMNAMEN1 | |
| SCHEMBL26188077 | 0.71 | S100B (0.69) | ALDH1A1MAPTPOLBLMNAMEN1 | |
| SCHEMBL95343 | 0.71 | TEAD4 (0.74) | CYP2C9TEAD4ALDH1A1MAPTPOLB | |
| SCHEMBL83814 | 0.71 | TEAD4 (0.74) | CYP2C9TEAD4ALDH1A1MAPTPOLB | |
| SCHEMBL83863 | 0.71 | TEAD4 (0.74) | CYP2C9TEAD4ALDH1A1MAPTPOLB | |
| SCHEMBL15443610 | 0.70 | CYP2C9 (0.48) | CYP2D6CYP2C9ALDH1A1MAPTTDP1 |
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-10344115-B2 | Amine glyoxal resins | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2019-07-09 | — | — | US | disclosed |