Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | QPCT | Q16769 | 1/20 | 0.37 |
| ▸ | TACR2 | P21452 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PRCP | P42785 | 1/20 | 0.36 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8377175 | 0.87 | CASR (0.40) | ALDH1A1KMT2AQPCTMEN1EGFR | |
| SCHEMBL8376002 | 0.85 | L3MBTL1 (0.39) | ALDH1A1KMT2ALMNAL3MBTL1QPCT | |
| SCHEMBL8377218 | 0.83 | QPCT (0.40) | ALDH1A1KMT2ALMNAL3MBTL1QPCT | |
| SCHEMBL8377108 | 0.72 | CYP1A2 (0.41) | ALDH1A1KMT2ALMNAL3MBTL1QPCT | |
| SCHEMBL8375998 | 0.71 | GAA (0.37) | ALDH1A1BCHEACHEKMT2ALMNA | |
| SCHEMBL8377217 | 0.69 | HTR2A (0.42) | KMT2AMEN1 | |
| SCHEMBL3508765 | 0.69 | ALDH1A1 (0.43) | ALDH1A1KMT2ALMNAQPCTMEN1 | |
| SCHEMBL6865258 | 0.67 | ALDH1A1 (0.69) | ALDH1A1BCHEKMT2ALMNAMEN1 | |
| SCHEMBL8376042 | 0.67 | SMN1; SMN2 (0.41) | ALDH1A1KMT2ALMNAL3MBTL1CYP1A2 | |
| SCHEMBL8184622 | 0.65 | CYP3A4 (0.45) | ALDH1A1ACHELMNACYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5925766-A | COGNITION ACTIVATORS FOR DECREASING CHOLINERGIC FUNCTION OF ALZHEIMER*S DISEASE AND ARE ENZYME INHIBITORS OF MONOAMINE OXIDASE AND ARE ANTIDEPRESSANTS | HOECHST MARION ROUSSEL, INC. (US) | 1999-07-20 | — | — | US | disclosed |
| US-5756754-A | Substituted 3-(aminoalkylamino)-1,2-benzisoxazoles and related compounds | HOECHST MARION ROUSSEL, INC. (US) | 1998-05-26 | — | — | US | disclosed |