Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 2/20 | 0.42 |
| ▸ | KLK7 | P49862 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28278105 | 0.84 | LMNA (0.47) | ATML3MBTL1CYP1A2TSHRELANE | |
| SCHEMBL16672960 | 0.83 | TSHR (0.55) | ATML3MBTL1CYP1A2TSHRALDH1A1 | |
| SCHEMBL18651711 | 0.83 | TSHR (0.48) | ATML3MBTL1CYP1A2TSHRELANE | |
| SCHEMBL28008652 | 0.81 | L3MBTL1 (0.46) | ATML3MBTL1CYP1A2TSHRELANE | |
| SCHEMBL16673133 | 0.78 | ALDH1A1 (0.46) | ATML3MBTL1CYP1A2TSHRALDH1A1 | |
| SCHEMBL28095822 | 0.78 | L3MBTL1 (0.43) | ATML3MBTL1CYP1A2TSHRELANE | |
| SCHEMBL19105214 | 0.77 | ATM (0.51) | ATML3MBTL1CYP1A2TSHRELANE | |
| SCHEMBL650209 | 0.77 | ATM (0.51) | ATML3MBTL1CYP1A2TSHRELANE | |
| SCHEMBL27606651 | 0.76 | TSHR (0.49) | L3MBTL1TSHRMAPTALDH1A1TDP1 | |
| SCHEMBL31359579 | 0.76 | ALDH1A1 (0.57) | ATML3MBTL1ELANEKLK7MAPT |
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-105949200-A | Method for synthesizing 5-arylpyrazole [1, 5-alpha] pyrimindine derivatives | 重庆医药高等专科学校 | 2016-09-21 | — | — | CN | disclosed |