Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | NOS1 | P29475 | 2/20 | 0.46 |
| ▸ | NOS2 | P35228 | 2/20 | 0.46 |
| ▸ | NOS3 | P29474 | 1/20 | 0.46 |
| ▸ | ARG1 | P05089 | 1/20 | 0.41 |
| ▸ | ARG2 | P78540 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9818358 | 1.00 | MEN1 (0.47) | MEN1CYP1A2KMT2AALDH1A1THRB | |
| Hydrochloric Acid SCHEMBL29492459 | 0.90 | NOS1 (0.54) | MEN1CYP1A2KMT2AALDH1A1THRB | |
| SCHEMBL16950253 | 0.77 | KIF11 (0.41) | MEN1CYP1A2KMT2AALDH1A1THRB | |
| Hydrochloric Acid SCHEMBL9639748 | 0.75 | NOS2 (0.43) | MEN1CYP1A2KMT2AALDH1A1THRB | |
| SCHEMBL58260 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL1133986 | 0.73 | MEN1 (0.62) | MEN1CYP1A2KMT2AALDH1A1THRB | |
| Acetic Acid SCHEMBL103302 | 0.71 | MEN1 (0.60) | MEN1CYP1A2KMT2AALDH1A1THRB | |
| SCHEMBL18370 | 0.70 | — | — | |
| SCHEMBL7567590 | 0.70 | MEN1 (0.46) | MEN1CYP1A2KMT2AALDH1A1THRB | |
| SCHEMBL11055975 | 0.70 | TSHR (0.37) | MEN1CYP1A2KMT2AALDH1A1THRB |
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-8945933-B2 | Liquid chromatography-mass spectrometry methods for multiplexed detection and quantitation of free amino acids | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2015-02-03 | — | — | US | disclosed |
| US-20110085983-A1 | Liquid Chromatography-Mass Spectrometry Methods For Multiplexed Detection and Quantitation of Free Amino Acids | THE BOARDS OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2011-04-14 | — | — | US | disclosed |