Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | DNM1 | Q05193 | 8/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7794500 | 0.90 | TSHR (0.65) | TSHRALDH1A1TDP1THRBDNM1 | |
| SCHEMBL27890170 | 0.87 | — | — | |
| SCHEMBL9285670 | 0.87 | TSHR (0.92) | TSHRALDH1A1TDP1THRBDNM1 | |
| SCHEMBL3164 | 0.87 | — | — | |
| SCHEMBL276808 | 0.87 | — | — | |
| Hexane SCHEMBL8845002 | 0.87 | TSHR (0.92) | TSHRALDH1A1TDP1THRBDNM1 | |
| Methylene Chloride SCHEMBL25428166 | 0.83 | — | — | |
| SCHEMBL11742005 | 0.83 | TSHR (1.00) | TSHRALDH1A1TDP1THRBDNM1 | |
| Butyl Chloride SCHEMBL8040894 | 0.83 | TSHR (0.86) | TSHRALDH1A1TDP1THRBDNM1 | |
| SCHEMBL22186971 | 0.83 | TSHR (1.00) | TSHRALDH1A1TDP1THRBDNM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110272415-A | 3,4- dihydro pyrido [4,3-d] pyridine derivatives and its preparation method and application | 武汉宇科源医药生物科技有限公司 | 2019-09-24 | — | — | CN | disclosed |