Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8304467 | 0.89 | ALDH1A1 (0.51) | ALDH1A1NPSR1TDP1KMT2AMEN1 | |
| SCHEMBL9203039 | 0.88 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1TDP1KMT2AMEN1 | |
| SCHEMBL9195711 | 0.87 | MEN1 (0.55) | KMT2AMEN1HTTRAB9AFOLH1 | |
| SCHEMBL9203364 | 0.80 | HTT (0.47) | ALDH1A1L3MBTL1CYP3A4NPSR1CYP1A2 | |
| SCHEMBL9197479 | 0.80 | MEN1 (0.56) | KMT2AMEN1POLBNR4A2SRD5A2 | |
| SCHEMBL9195985 | 0.80 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1CYP3A4NPSR1CYP1A2 | |
| SCHEMBL1316640 | 0.79 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1TDP1KMT2AMEN1 | |
| SCHEMBL9201021 | 0.78 | PTGER1 (0.54) | KMT2AMEN1HTTRAB9AFOLH1 | |
| SCHEMBL23809724 | 0.77 | ALDH1A1 (0.62) | ALDH1A1L3MBTL1CYP3A4NPSR1TDP1 | |
| SCHEMBL3634188 | 0.77 | ALDH1A1 (0.80) | ALDH1A1L3MBTL1CYP3A4NPSR1CYP1A2 |
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-0687249-A1 | BALANOIDS | ELI LILLY AND COMPANY (US) | 1995-12-20 | — | — | EP | disclosed |
| WO-1994020062-A2 | BALANOIDS AS PROTEIN KINASE C INHIBITORS | ELI LILLY AND COMPANY (US) | 1994-09-15 | — | — | WO | disclosed |