Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.51 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1170984 | 0.98 | ALDH1A1 (0.55) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 | |
| Hydrochloric Acid SCHEMBL27629202 | 0.96 | ALDH1A1 (0.53) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 | |
| SCHEMBL8777369 | 0.85 | P2RX4 (0.50) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 | |
| SCHEMBL7887522 | 0.81 | P2RX4 (0.49) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 | |
| SCHEMBL323456 | 0.80 | ALDH1A1 (0.52) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 | |
| SCHEMBL432657 | 0.78 | KMT2A (0.49) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 | |
| SCHEMBL22084929 | 0.78 | MAOB (0.48) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 | |
| SCHEMBL27391678 | 0.78 | ALDH1A1 (0.50) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 | |
| SCHEMBL22819131 | 0.77 | ALDH1A1 (0.60) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 | |
| SCHEMBL30699499 | 0.77 | ALDH1A1 (0.49) | ALDH1A1P2RX4KMT2AL3MBTL1TDP1 |
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-112513021-B | ROR gamma antagonist and application thereof in medicines | 广东东阳光药业有限公司 | 2023-06-27 | — | — | CN | disclosed |