Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 1.00 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL11887 | 1.00 | — | — | |
| Iodide SCHEMBL9013648 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL515756 | 0.96 | — | — | |
| Fluoride SCHEMBL7708424 | 0.96 | ACHE (0.93) | ACHETEAD4ALDH1A1TDP1MAPT | |
| Hydrochloric Acid SCHEMBL10938359 | 0.96 | ACHE (0.93) | ACHETEAD4ALDH1A1TDP1MAPT | |
| SCHEMBL5838050 | 0.96 | — | — | |
| Ethane SCHEMBL7215590 | 0.96 | ACHE (0.93) | ACHETEAD4ALDH1A1TDP1MAPT | |
| Methylamine SCHEMBL11822116 | 0.96 | ACHE (0.93) | ACHETEAD4ALDH1A1TDP1MAPT | |
| Hydrochloric Acid SCHEMBL4376618 | 0.96 | ACHE (0.93) | ACHETEAD4ALDH1A1TDP1MAPT | |
| Ammonia Solution, Strong SCHEMBL4839623 | 0.96 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012168470-A1 | METHOD FOR THE DETERMINATION OF THE CONCENTRATION OF VITAMIN B6 IN A SAMPLE | BÜHLMANN LABORATORIES AG (CH) | 2012-12-13 | — | — | WO | claimed |
| CN-104593095-A | High octane unleaded aviation gasoline | SHELL INT RESEARCH | 2015-05-06 | — | — | CN | disclosed |
| CN-104593096-A | High octane unleaded aviation gasoline | SHELL INT RESEARCH | 2015-05-06 | — | — | CN | disclosed |
| CN-104593094-A | High octane unleaded aviation gasoline | SHELL INT RESEARCH | 2015-05-06 | — | — | CN | disclosed |
| WO-2012168470-A1 | METHOD FOR THE DETERMINATION OF THE CONCENTRATION OF VITAMIN B6 IN A SAMPLE | BÜHLMANN LABORATORIES AG (CH) | 2012-12-13 | — | — | WO | disclosed |
| US-5874443-A | BIOSYNTHESIS | TREGA BIOSCIENCES, INC. (US) | 1999-02-23 | — | — | US | disclosed |
| US-5432283-A | Substituted phenyl in 2 position; intermediates for drugs to treat hypertensive pathologies, cardiac, renal or pulmonary insufficiencies, and glaucoma | SYNTHELABO (FR) | 1995-07-11 | — | — | US | disclosed |
| US-5371227-A | Quinoline derivatives, process for their preparation, and their therapeutic applications | SYNTHELABO (FR) | 1994-12-06 | — | — | US | disclosed |