Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | F13A1 | P00488 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 2/20 | 0.38 |
| ▸ | CA6 | P23280 | 2/20 | 0.38 |
| ▸ | CA5A | P35218 | 2/20 | 0.38 |
| ▸ | THPO | P40225 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.38 |
| ▸ | CASP2 | P42575 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL6657787 | 0.79 | ALDH1A1 (0.39) | TSHRCYP1A2MEN1KMT2AALDH1A1 | |
| SCHEMBL6662508 | 0.77 | ALDH1A1 (0.37) | TSHRCYP1A2MEN1KMT2AALDH1A1 | |
| SCHEMBL6661804 | 0.77 | ALDH1A1 (0.37) | TSHRCYP1A2MEN1KMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL16794733 | 0.77 | RELA (0.41) | TDP1RELATSHRALOX15CA12 | |
| Hydrochloric Acid SCHEMBL28912068 | 0.75 | RELA (0.40) | TDP1RELATSHRALOX15CA12 | |
| SCHEMBL7170238 | 0.73 | TSHR (0.54) | TDP1RELATSHRALOX15CA12 | |
| SCHEMBL10809305 | 0.73 | — | — | |
| SCHEMBL28218323 | 0.73 | PLA2G1B (0.42) | TSHRLMNA | |
| SCHEMBL27670692 | 0.73 | DNM1 (0.39) | TSHRCA12CA2CA9CA1 | |
| SCHEMBL9226800 | 0.73 | PLA2G1B (0.42) | TSHRLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110291397-A | Methods for detecting and treating lung cancer | 得克萨斯大学体系董事会 | 2019-09-27 | — | — | CN | disclosed |
| CN-110121647-A | Method for detecting and treating ductal adenocarcinoma of pancreas | 得克萨斯大学体系董事会 | 2019-08-13 | — | — | CN | disclosed |