Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL312703 | 0.74 | TSHR (0.38) | LMNAMEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL7404048 | 0.74 | ALDH1A1 (0.36) | MEN1KMT2ACYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL5790406 | 0.72 | SIRT2 (0.43) | PIN1LMNATDP1L3MBTL1MEN1 | |
| SCHEMBL9571780 | 0.71 | GABRG2 (0.42) | NPC1GABRA1GABRB2ALDH1A1GABRA2 | |
| SCHEMBL7467650 | 0.70 | TP53 (0.48) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6666547 | 0.70 | TRPA1 (0.31) | — | |
| SCHEMBL6885776 | 0.69 | CYP2C19 (0.33) | HIF1ACYP2C19CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL7534704 | 0.68 | HIF1A (0.37) | MEN1KMT2ACYP1A2HIF1ACYP2C19 | |
| SCHEMBL5063081 | 0.68 | LTA4H (0.43) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL12907335 | 0.67 | CYP11B1 (0.37) | LMNATDP1L3MBTL1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006005726-A2 | HETEROCYCLIC COMPOUNDS | SPEEDEL EXPERIMENTA AG (CH) | 2006-01-19 | — | — | WO | disclosed |