Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.33 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
| ▸ | ADH4 | P08319 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL11588990 | 1.00 | DNM1 (0.37) | DNM1TSHRALDH1A1ZDHHC20ZDHHC2 | |
| SCHEMBL11566919 | 0.88 | TSHR (0.35) | DNM1TSHRALDH1A1 | |
| SCHEMBL11566916 | 0.88 | TSHR (0.35) | DNM1TSHRALDH1A1 | |
| SCHEMBL9053655 | 0.80 | DNM1 (0.48) | DNM1TSHRS1PR2S1PR1S1PR3 | |
| SCHEMBL10379497 | 0.78 | DNM1 (0.52) | DNM1TSHRALDH1A1ADH1CADH1A | |
| SCHEMBL3504027 | 0.76 | DNM1 (0.40) | DNM1TSHRALDH1A1ZDHHC20ZDHHC2 | |
| SCHEMBL22157417 | 0.75 | DNM1 (0.43) | DNM1TSHRALDH1A1ZDHHC20ZDHHC2 | |
| SCHEMBL18325052 | 0.75 | DNM1 (0.50) | DNM1TSHRALDH1A1ADH1CADH1A | |
| SCHEMBL18325057 | 0.75 | DNM1 (0.50) | DNM1TSHRALDH1A1ADH1CADH1A | |
| SCHEMBL15785591 | 0.75 | DNM1 (0.32) | DNM1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0268964-B1 | PROCESS FOR THE PREPARATION OF 6-HYDROXY-3-PYRIDINE-CARBOXYLIC-ACID ESTERS | BAYER AG (DE) | 1991-05-15 | — | — | EP | claimed |
| US-4105853-A | FOR USE IN STEREO-CONTROLLED SYNTHESIS OF SUBSTITUTED DECAHYDROQUINOLINES AND PUMILIOTOXIN C | CHON CORPORATION (US) | 1978-08-08 | — | — | US | disclosed |
| US-4065496-A | ACYLATION OF CONJUGATED AZOMETHINE | CHON CORPORATION (US) | 1977-12-27 | — | — | US | disclosed |