Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.38 |
| ▸ | PIK3R1 | P27986 | 4/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9319457 | 0.84 | POLB (0.49) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL9319939 | 0.81 | ALDH1A1 (0.42) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL9319323 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL9318828 | 0.79 | KDM4E (0.65) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL12479744 | 0.75 | KDM4E (0.48) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL9320881 | 0.74 | ALDH1A1 (0.50) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL25084330 | 0.74 | KRAS (0.51) | LMNAMEN1KMT2A | |
| SCHEMBL12480220 | 0.73 | PTGDR2 (0.44) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL9318038 | 0.73 | KMT2A (0.52) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL17024952 | 0.72 | PLA2G4A (0.45) | ALDH1A1KDM4ELMNA |
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-5019570-A | Antibioics | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-05-28 | — | — | US | disclosed |