Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8131767 | 0.88 | ALDH1A1 (0.42) | ALDH1A1KDM4ENPSR1SMN1; SMN2TSHR | |
| SCHEMBL6732082 | 0.84 | ALDH1A1 (0.43) | ALDH1A1KDM4ENPSR1SMN1; SMN2TSHR | |
| SCHEMBL27496654 | 0.77 | TSHR (0.38) | ALDH1A1KDM4ESMN1; SMN2TSHRKMT2A | |
| SCHEMBL8133633 | 0.76 | TSHR (0.52) | ALDH1A1KDM4ETSHRKMT2AMAPT | |
| SCHEMBL417882 | 0.72 | TSHR (0.44) | ALDH1A1KDM4ENPSR1SMN1; SMN2TSHR | |
| SCHEMBL25152621 | 0.71 | TSHR (0.46) | ALDH1A1KDM4ENPSR1TSHRKMT2A | |
| SCHEMBL16302043 | 0.71 | TSHR (0.61) | ALDH1A1KDM4ESMN1; SMN2TSHRKMT2A | |
| SCHEMBL19750182 | 0.70 | HSD17B2 (0.53) | ALDH1A1KDM4ESMN1; SMN2TSHRKMT2A | |
| SCHEMBL13870580 | 0.70 | HSD17B2 (0.49) | ALDH1A1TSHRKMT2AMEN1MAPT | |
| SCHEMBL23706692 | 0.69 | CA12 (0.51) | KDM4ESMN1; SMN2TSHRMAPTCA12 |
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-1184477-A | Pyrazole derivatives | IDEMITSU KOSAN CO (JP) | 1998-06-10 | — | — | CN | disclosed |
| EP-0818455-A1 | PYRAZOLE DERIVATIVES | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1998-01-14 | — | — | EP | disclosed |