Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | OGG1 | O15527 | 1/20 | 0.43 |
| ▸ | MMP3 | P08254 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10775545 | 0.82 | GAA (0.51) | GAAMAPTALDH1A1KDM4ECYP1A2 | |
| SCHEMBL856182 | 0.81 | MAPT (0.50) | GAAMAPTALDH1A1KDM4ECYP1A2 | |
| SCHEMBL1639535 | 0.81 | ALOX15 (0.55) | GAAMAPTALDH1A1KDM4ECYP1A2 | |
| SCHEMBL9687212 | 0.79 | MAPT (0.49) | GAAMAPTALDH1A1KDM4ECYP1A2 | |
| SCHEMBL12235110 | 0.79 | NCEH1 (0.50) | MAPTALDH1A1KDM4ECYP1A2CYP2C19 | |
| SCHEMBL28069317 | 0.78 | ALDH1A1 (0.59) | GAAMAPTALDH1A1KDM4ECYP1A2 | |
| SCHEMBL27876343 | 0.78 | NCEH1 (0.56) | MAPTALDH1A1KDM4EMMP3MEN1 | |
| SCHEMBL5480836 | 0.78 | WDR5 (0.56) | GAAMAPTALDH1A1KDM4ECYP1A2 | |
| SCHEMBL7536138 | 0.77 | GAA (0.47) | GAAMAPTALDH1A1KDM4ECYP1A2 | |
| SCHEMBL5713253 | 0.76 | ALDH1A1 (0.46) | GAAMAPTALDH1A1KDM4ECYP1A2 |
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-2002102301-A2 | SUBSTITUTED INDOLE-2-CARBOXYLIC ACID BENZYLIDENE-HYDRAZIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF | CYTOVIA, INC. (US) | 2002-12-27 | — | — | WO | disclosed |