Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | ADH1C | P00326 | 1/20 | 0.34 |
| ▸ | ADH1A | P07327 | 1/20 | 0.34 |
| ▸ | ADH4 | P08319 | 1/20 | 0.34 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.33 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.33 |
| ▸ | GGPS1 | O95749 | 3/20 | 0.32 |
| ▸ | GBA1 | P04062 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2308384 | 0.98 | DNM1 (0.41) | DNM1TSHRTHRBMGLLCA12 | |
| SCHEMBL564627 | 0.98 | DNM1 (0.39) | DNM1TSHRTHRBMGLLCA12 | |
| SCHEMBL4438505 | 0.93 | DNM1 (0.36) | DNM1TSHRMGLL | |
| SCHEMBL7497954 | 0.89 | DNM1 (0.36) | DNM1MGLL | |
| SCHEMBL4203223 | 0.86 | ALDH1A1 (0.31) | TSHRCA12CA1CA9 | |
| SCHEMBL7803023 | 0.82 | CA12 (0.33) | MGLLCA12CA1CA9 | |
| SCHEMBL4199252 | 0.77 | DNM1 (0.42) | DNM1TSHRTHRBMGLLCA12 | |
| SCHEMBL7687639 | 0.76 | DNM1 (0.36) | DNM1MGLL | |
| SCHEMBL14841879 | 0.72 | DNM1 (0.52) | DNM1TSHRTHRBMGLLCA12 | |
| SCHEMBL11366194 | 0.72 | DNM1 (0.52) | DNM1TSHRTHRBMGLLCA12 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2027095-A1 | HETEROAROYL-SUBSTITUTED ALANINES WITH A HERBICIDAL ACTION | BASF SE (DE) | 2009-02-25 | — | — | EP | disclosed |
| EP-2024327-A1 | BENZOYL-SUBSTITUTED ALANINES | BASF SE (DE) | 2009-02-18 | — | — | EP | disclosed |
| WO-2007134984-A1 | HETEROAROYL-SUBSTITUTED ALANINES WITH A HERBICIDAL ACTION | BASF SE (DE) | 2007-11-29 | — | — | WO | disclosed |
| WO-2007134971-A1 | BENZOYL-SUBSTITUTED ALANINES | BASF SE (DE) | 2007-11-29 | — | — | WO | disclosed |