Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.52 |
| ▸ | KDM1A | O60341 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | FBP1 | P09467 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28472907 | 1.00 | TRPA1 (0.52) | TRPA1KDM1AMEN1KMT2AALDH1A1 | |
| SCHEMBL59713 | 0.89 | KDM1A (0.48) | TRPA1KDM1AMEN1KMT2AALDH1A1 | |
| SCHEMBL216869 | 0.86 | TSHR (0.43) | TRPA1MEN1KMT2AALDH1A1TSHR | |
| SCHEMBL1758410 | 0.81 | CYP2A6 (0.38) | TRPA1LMNARECQLTDP1ESR1 | |
| SCHEMBL11908074 | 0.81 | CYP2A6 (0.38) | TRPA1LMNARECQLTDP1ESR1 | |
| SCHEMBL17329401 | 0.81 | KDM1A (0.47) | TRPA1KDM1AMEN1KMT2AALDH1A1 | |
| SCHEMBL9312061 | 0.81 | LMNA (0.47) | TRPA1KDM1AMEN1KMT2AALDH1A1 | |
| SCHEMBL7304675 | 0.81 | NR1I2 (0.44) | TRPA1KDM1AMEN1KMT2AALDH1A1 | |
| SCHEMBL7304680 | 0.81 | NR1I2 (0.44) | TRPA1KDM1AMEN1KMT2AALDH1A1 | |
| SCHEMBL2244765 | 0.80 | LMNA (0.44) | TRPA1KDM1AMEN1KMT2AALDH1A1 |
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-109863137-B | LSD1 inhibitors and medical uses thereof | 星座制药公司 | 2022-12-16 | — | — | CN | disclosed |
| CN-109863137-A | LSD1 inhibitor and its medical usage | 星座制药公司 | 2019-06-07 | — | — | CN | disclosed |