Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RBP4 | P02753 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7558692 | 1.00 | PARP1 (0.42) | PARP1ALDH1A1TSHRRECQLSMN1; SMN2 | |
| SCHEMBL8232622 | 1.00 | PARP1 (0.42) | PARP1ALDH1A1TSHRRECQLSMN1; SMN2 | |
| SCHEMBL8238415 | 0.86 | RBP4 (0.42) | ALDH1A1TSHRRECQLSMN1; SMN2ACHE | |
| SCHEMBL9706890 | 0.86 | RBP4 (0.42) | ALDH1A1TSHRRECQLSMN1; SMN2ACHE | |
| SCHEMBL7193232 | 0.86 | RBP4 (0.42) | ALDH1A1TSHRRECQLSMN1; SMN2ACHE | |
| SCHEMBL22541399 | 0.82 | GAA (0.41) | ALDH1A1SMN1; SMN2POLBMAPTL3MBTL1 | |
| SCHEMBL1704378 | 0.75 | CNR2 (0.36) | ALDH1A1 | |
| SCHEMBL3054057 | 0.75 | CNR2 (0.36) | ALDH1A1 | |
| SCHEMBL8259156 | 0.74 | TSHR (0.41) | PARP1ALDH1A1TSHRRECQLSMN1; SMN2 | |
| SCHEMBL8257096 | 0.74 | TSHR (0.41) | PARP1ALDH1A1TSHRRECQLSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002066417-A1 | METHOD FOR THE PRODUCTION OF THE ENANTIOMERS OF 2-SUBSTITUTED BETA AMINO ACIDS | CHIROBLOCK GMBH (DE) | 2002-08-29 | — | — | WO | disclosed |
| US-6372936-B1 | REACTING AMINO PROTECTED RACEMIC 3-AMINO-2-METHYL PROPIONIC ACID WITH ENANTIOMER OF CHIRAL AMINE TO FORM DIASTEREOMERIC SALTS, RECRYSTALLIZING SALTS FROM ETHYL ACETATE TO SEPARATE, RELEASING RESOLVED ACID WITH SOLUTION OF INORGANIC BASE | ELI LILLY AND COMPANY | 2002-04-16 | — | — | US | disclosed |
| EP-1059286-A1 | Optical resolution of aminoisobutyric acid | ELI LILLY AND COMPANY (US) | 2000-12-13 | — | — | EP | disclosed |