Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL26200999 | 0.92 | THRA (0.43) | ELANETHRBTHRAMAPTALDH1A1 | |
| SCHEMBL26201485 | 0.84 | FFAR1 (0.40) | ELANETHRAALDH1A1FFAR1KDM4E | |
| SCHEMBL26201178 | 0.83 | ELANE (0.35) | ELANETHRBTHRAMAPTALDH1A1 | |
| SCHEMBL26200980 | 0.82 | MAPT (0.51) | THRBTHRAMAPTALDH1A1CRHR1 | |
| SCHEMBL26200983 | 0.80 | LMNA (0.38) | ELANEMAPTALDH1A1MCL1KMT2A | |
| SCHEMBL26200975 | 0.77 | GRIN2D (0.39) | MAPTCA1CA2CA9KDM4E | |
| SCHEMBL30388036 | 0.76 | LMNA (0.36) | ELANETHRBTHRAMAPTALDH1A1 | |
| SCHEMBL26201031 | 0.76 | ALDH1A1 (0.42) | ELANEMAPTALDH1A1CRHR1KDM4E | |
| SCHEMBL26201193 | 0.75 | PTGS1 (0.44) | ELANETHRBTHRAMAPTALDH1A1 | |
| SCHEMBL9123683 | 0.75 | ELANE (0.49) | ELANEMAPTALDH1A1MAPK1GAA |
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-20230280275-A1 | PHOTOACTIVATABLE VIBRATIONAL PROBES AND USES THEREOF | CALIFORNIA INSTITUTE OF TECHNOLOGY | 2023-09-07 | — | — | US | disclosed |