Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | CFTR | P13569 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.34 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5240230 | 1.00 | CYP1A2 (0.45) | CYP1A2ALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5235146 | 0.91 | CYP1A2 (0.40) | CYP1A2ALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5235150 | 0.91 | CYP1A2 (0.40) | CYP1A2ALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5233927 | 0.89 | KDR (0.38) | CYP1A2ALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5233924 | 0.89 | KDR (0.38) | CYP1A2ALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5239587 | 0.89 | AR (0.39) | CYP1A2ALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5239591 | 0.89 | AR (0.39) | CYP1A2ALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5239266 | 0.87 | CYP1A2 (0.41) | CYP1A2ALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5239257 | 0.87 | CYP1A2 (0.41) | CYP1A2ALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5235216 | 0.86 | KDR (0.44) | CYP1A2LMNATACR1RAB9APOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1397364-B1 | NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | LILLY CO ELI (US) | 2007-07-25 | — | — | EP | disclosed |