Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MPI | P34949 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9319149 | 0.79 | KDM4E (0.55) | ALDH1A1HPGDKDM4EGAAMAPT | |
| SCHEMBL9319332 | 0.77 | ALDH1A1 (0.46) | ALDH1A1HPGDGPR35KDM4EGAA | |
| SCHEMBL12414516 | 0.68 | HTT (0.50) | ALDH1A1HPGDKDM4EGAAMAPT | |
| SCHEMBL8568000 | 0.65 | KDM4E (0.41) | ALDH1A1HPGDGPR35KDM4EGAA | |
| SCHEMBL10541146 | 0.65 | ALDH1A1 (0.45) | ALDH1A1HPGDKDM4EGAAMAPT | |
| SCHEMBL10939957 | 0.65 | KDM4E (0.67) | ALDH1A1HPGDKDM4EGAAMAPT | |
| SCHEMBL22041626 | 0.65 | GPR35 (0.64) | HPGDGPR35ADORA3ADORA2AADORA1 | |
| SCHEMBL7362334 | 0.64 | KDM4E (0.47) | ALDH1A1HPGDKDM4EGAAMAPT | |
| SCHEMBL8194941 | 0.64 | CA9 (0.61) | GPR35KDM4ELMNASMN1; SMN2BLM | |
| SCHEMBL17204726 | 0.64 | CA12 (0.50) | ALDH1A1HPGDGPR35KDM4EGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5371220-A | Bicyclo-heterocyclic intermediates for cephalosporin compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-12-06 | — | — | US | disclosed |
| US-5019570-A | Antibioics | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-05-28 | — | — | US | disclosed |