Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27665757 | 0.90 | AKR1C3 (0.45) | AKR1C3AKR1C2ALDH1A1KDM4EEPHX1 | |
| SCHEMBL27665594 | 0.88 | EPHX1 (0.42) | AKR1C3AKR1C2ALDH1A1KDM4EEPHX1 | |
| SCHEMBL27644158 | 0.88 | AKR1C3 (0.43) | AKR1C3AKR1C2ALDH1A1KDM4EEPHX1 | |
| SCHEMBL4986597 | 0.85 | AKR1C3 (0.43) | AKR1C3AKR1C2ALDH1A1KDM4EEPHX1 | |
| SCHEMBL27644071 | 0.84 | TSHR (0.40) | AKR1C3AKR1C2KDM4ESMN1; SMN2HSD17B10 | |
| SCHEMBL27665341 | 0.83 | AKR1C3 (0.43) | AKR1C3AKR1C2ALDH1A1KDM4EEPHX1 | |
| SCHEMBL27644642 | 0.83 | ADRA1A (0.52) | HSD17B10TSHRHTTLMNAMEN1 | |
| SCHEMBL27644693 | 0.82 | SLC7A5 (0.41) | AKR1C3AKR1C2KDM4ESMN1; SMN2HSD17B10 | |
| SCHEMBL27665267 | 0.81 | ALDH1A1 (0.44) | AKR1C3AKR1C2ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL27644833 | 0.81 | SLC7A5 (0.40) | ALDH1A1KDM4ESMN1; SMN2HSD17B10NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1886363-A | Amino acids with affinity for the alpha2delta-protein | WARNER LAMBERT CO (US) | 2006-12-27 | — | — | CN | claimed |
| CN-1886363-A | Amino acids with affinity for the alpha2delta-protein | WARNER LAMBERT CO (US) | 2006-12-27 | — | — | CN | disclosed |