Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | CPT1A | P50416 | 7/20 | 0.47 |
| ▸ | CPT2 | P23786 | 5/20 | 0.47 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5637768 | 0.85 | KDM4E (0.54) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL5637475 | 0.81 | KDM4E (0.51) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL5640756 | 0.80 | KDM4E (0.49) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL5640744 | 0.80 | KDM4E (0.49) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL14515747 | 0.76 | KDM4E (0.45) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL11861407 | 0.72 | GAA (1.00) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL11424895 | 0.72 | CPT1A (0.67) | ALDH1A1SMN1; SMN2CPT1ACPT2CPT1B | |
| SCHEMBL10064244 | 0.71 | MEN1 (0.83) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL14578664 | 0.70 | HPGD (0.76) | KDM4EMEN1KMT2AALDH1A1LMNA | |
| SCHEMBL29516320 | 0.70 | MEN1 (0.86) | GAAKDM4EMEN1KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1534681-A1 | SUBSTITUTED QUINOLINE CCR5 RECEPTOR ANTAGONISTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2005-06-01 | — | — | EP | disclosed |
| WO-2004002960-A1 | SUBSTITUTED QUINOLINE CCR5 RECEPTOR ANTAGONISTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2004-01-08 | — | — | WO | disclosed |