Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9886148 | 0.88 | CYP19A1 (0.50) | TSHRHTTPOLBALOX5MAPT | |
| SCHEMBL13598125 | 0.85 | TSHR (0.65) | TSHRACHEHTTPOLBHSD17B10 | |
| SCHEMBL27959715 | 0.84 | TSHR (0.59) | TSHRACHEHTTPOLBHSD17B10 | |
| SCHEMBL14326989 | 0.84 | TSHR (0.59) | TSHRACHEHTTPOLBHSD17B10 | |
| SCHEMBL4532852 | 0.81 | TSHR (0.55) | TSHRACHEHTTPOLBHSD17B10 | |
| SCHEMBL11640381 | 0.80 | ALOX5 (0.45) | TSHRHTTPOLBALOX5MAPT | |
| SCHEMBL16954441 | 0.80 | ALOX5 (0.45) | TSHRHTTPOLBALOX5MAPT | |
| SCHEMBL16950489 | 0.80 | ALOX5 (0.45) | TSHRHTTPOLBALOX5MAPT | |
| SCHEMBL10748504 | 0.80 | TSHR (0.53) | TSHRACHEHTTHSD17B10MAPT | |
| SCHEMBL14390 | 0.80 | TSHR (0.53) | TSHRACHEHTTPOLBHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3202765-A1 | POLYCYCLIC ANAPLASTIC LYMPHOMA KINASE INHIBITOR | Xuanzhu Pharma Co., Ltd. (CN) | 2017-08-09 | — | — | EP | disclosed |
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |