Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.61 |
| ▸ | PKM | P14618 | 2/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | SCN1A | P35498 | 1/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.47 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1953298 | 0.89 | MAPK1 (0.73) | MAPK1PKMHSD17B10ALDH1A1KDM4E | |
| SCHEMBL17984534 | 0.86 | MAPK1 (0.65) | MAPK1PKMHSD17B10ALDH1A1KDM4E | |
| SCHEMBL1953300 | 0.86 | MAPK1 (0.65) | MAPK1PKMHSD17B10ALDH1A1KDM4E | |
| SCHEMBL29096677 | 0.85 | MAPK1 (0.63) | MAPK1PKMHSD17B10ALDH1A1KDM4E | |
| Benzoic Acid 1-(3-Methyl)Butyl Ester SCHEMBL132524 | 0.84 | LMNA (0.65) | MAPK1PKMHSD17B10ALDH1A1KDM4E | |
| Benzoic Acid 1-(3-Methyl)Butyl Ester SCHEMBL28250108 | 0.84 | LMNA (0.65) | MAPK1PKMHSD17B10ALDH1A1KDM4E | |
| SCHEMBL17922769 | 0.83 | MAPK1 (0.65) | MAPK1PKMHSD17B10ALDH1A1KDM4E | |
| Formic Acid SCHEMBL22719985 | 0.83 | MAPK1 (0.65) | MAPK1PKMHSD17B10ALDH1A1KDM4E | |
| SCHEMBL1257797 | 0.83 | ESR1 (0.66) | MAPK1PKMHSD17B10ALDH1A1KDM4E | |
| SCHEMBL19690571 | 0.83 | MAPK1 (0.65) | MAPK1PKMHSD17B10ALDH1A1KDM4E |
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-2021038512-A1 | A PROCESS FOR MANUFACTURING SPECIALTY POLYESTERS & CO-POLYESTERS FROM RECYCLED BIS 2-HYDROXYETHYL TEREPHTHALATE (RBHET) AND PRODUCT THEREOF | KULKARNI SANJAY TAMMAJI (IN) | 2021-03-04 | — | — | WO | disclosed |