Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | DGKA | P23743 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | PAM | P19021 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2044963 | 0.90 | DNM1 (0.46) | DNM1CES1DGKACES2ALDH1A1 | |
| SCHEMBL28214910 | 0.86 | CES1 (0.43) | DNM1CES1DGKACES2ALDH1A1 | |
| SCHEMBL28129523 | 0.85 | CYP1A2 (0.42) | CYP1A2DNM1DGKAALDH1A1MAPT | |
| SCHEMBL16027624 | 0.84 | DNM1 (0.47) | CYP1A2DNM1CES1DGKACES2 | |
| SCHEMBL9249062 | 0.82 | DNM1 (0.46) | CYP1A2DNM1DGKAALDH1A1LMNA | |
| SCHEMBL24728778 | 0.82 | DNM1 (0.43) | DNM1CES1DGKACES2ALDH1A1 | |
| SCHEMBL6312523 | 0.80 | DNM1 (0.50) | DNM1CES1DGKACES2ALDH1A1 | |
| SCHEMBL28214917 | 0.80 | DNM1 (0.50) | DNM1CES1DGKACES2ALDH1A1 | |
| SCHEMBL11000352 | 0.80 | DNM1 (0.41) | CYP1A2DNM1DGKAALDH1A1MAPT | |
| SCHEMBL27824017 | 0.79 | CES1 (0.44) | DNM1CES1DGKACES2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010005737-A2 | ARTIFICIAL CARBOHYDRATE RECEPTORS AND METHODS OF USE THEREOF | FLORIDA ATLANTIC UNIVERSITY (US) | 2010-01-14 | — | — | WO | disclosed |