Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | CASR | P41180 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.30 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.30 |
| ▸ | RXRA | P19793 | 1/20 | 0.30 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.30 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22157863 | 0.91 | CA14 (0.42) | TSHRCA14HDAC6HDAC1HDAC2 | |
| SCHEMBL20262970 | 0.85 | CA14 (0.51) | TSHRCA14HDAC6HDAC1HDAC2 | |
| SCHEMBL7016953 | 0.84 | CA14 (0.46) | CA14HDAC6HDAC1HDAC2CA12 | |
| SCHEMBL18116039 | 0.84 | CA14 (0.41) | TSHRCA14HDAC6HDAC1HDAC2 | |
| SCHEMBL28686036 | 0.84 | KMT2A (0.44) | TSHRCA14HDAC6HDAC1HDAC2 | |
| SCHEMBL3838042 | 0.83 | CA14 (0.44) | TSHRCA14HDAC6HDAC1HDAC2 | |
| SCHEMBL25473057 | 0.82 | CA14 (0.53) | TSHRCA14HDAC6HDAC1HDAC2 | |
| SCHEMBL3734491 | 0.82 | CA14 (0.39) | TSHRCA14HDAC6HDAC1HDAC2 | |
| SCHEMBL20561267 | 0.82 | CA14 (0.47) | CA14HDAC6HDAC1HDAC2CA12 | |
| SCHEMBL19032434 | 0.82 | CA14 (0.47) | CA14HDAC6HDAC1HDAC2CA12 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114380717-A | Process for the preparation of 3- (tert-butoxycarbonyl-methoxycarbonylmethyl-amino) -propionic acid methyl ester and intermediates thereof | 郑州猫眼农业科技有限公司 | 2022-04-22 | — | — | CN | disclosed |
| CN-114380717-A | Process for the preparation of 3- (tert-butoxycarbonyl-methoxycarbonylmethyl-amino) -propionic acid methyl ester and intermediates thereof | 郑州猫眼农业科技有限公司 | 2022-04-22 | — | — | CN | disclosed |
| US-5539104-A | 1,4 Diazocines as fibrinogen antagonists | SMITHKLINE BEECHAM CORP. (US) | 1996-07-23 | — | — | US | disclosed |
| EP-0610432-A1 | C8-CYCLIC PEPTIDOMIMETICS AS FIBRINOGEN ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1994-08-17 | — | — | EP | disclosed |
| WO-1993009133-A1 | C8-CYCLIC PEPTIDOMIMETICS AS FIBRINOGEN ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1993-05-13 | — | — | WO | disclosed |