Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 8/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | F2 | P00734 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 2/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TTR | P02766 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TGM2 | P21980 | 1/20 | 0.42 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13725997 | 0.83 | CES1 (0.51) | CES1ALDH1A1KMT2ABCHECES2 | |
| SCHEMBL491136 | 0.81 | ALDH1A1 (0.57) | ALDH1A1F2HPGDKMT2AATM | |
| SCHEMBL10800205 | 0.80 | CES1 (0.57) | CES1ALDH1A1KMT2ABCHECES2 | |
| SCHEMBL29082812 | 0.80 | ALDH1A1 (0.56) | ALDH1A1F2HPGDKMT2AATM | |
| SCHEMBL27839876 | 0.79 | CES1 (0.56) | CES1ALDH1A1KMT2ABCHECES2 | |
| SCHEMBL25706975 | 0.78 | CES1 (0.46) | CES1ALDH1A1KMT2ABCHECES2 | |
| SCHEMBL25706970 | 0.76 | CES1 (0.45) | CES1ALDH1A1KMT2ABCHECES2 | |
| SCHEMBL27703399 | 0.76 | CES1 (0.56) | CES1ALDH1A1KMT2ABCHECTRB1 | |
| SCHEMBL16142447 | 0.75 | ALDH1A1 (0.50) | ALDH1A1HPGDKMT2AGAASMN1; SMN2 | |
| SCHEMBL25707085 | 0.75 | CES1 (0.51) | CES1ALDH1A1BCHECES2GAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230183391-A1 | BIOMASS DERIVED DIKETONES AS EFFICIENT VISIBLE LIGHT PHOTOINITIATORS | BOWLING GREEN STATE UNIVERSITY (US) | 2023-06-15 | — | — | US | disclosed |
| US-20230183391-A1 | BIOMASS DERIVED DIKETONES AS EFFICIENT VISIBLE LIGHT PHOTOINITIATORS | BOWLING GREEN STATE UNIVERSITY (US) | 2023-06-15 | — | — | US | disclosed |
| CN-111747883-B | 1-benzyl isatin derivative and synthesis method and application thereof | 中南大学 | 2022-07-01 | — | — | CN | disclosed |