Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CTSD | P07339 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL1585204 | 0.81 | TSHR (0.41) | ALDH1A1TSHRMEN1KMT2APTPN1 | |
| SCHEMBL6017682 | 0.81 | GPR35 (0.37) | ALDH1A1HTTTDP1GPR35TSHR | |
| SCHEMBL6017684 | 0.81 | GPR35 (0.37) | ALDH1A1HTTTDP1GPR35TSHR | |
| SCHEMBL10791330 | 0.78 | FBP1 (0.33) | NPSR1ALDH1A1HTTTSHRMEN1 | |
| SCHEMBL3578389 | 0.77 | MEN1 (0.50) | ALDH1A1MEN1KMT2A | |
| SCHEMBL9588210 | 0.77 | PTPRC (0.36) | ALDH1A1TDP1GPR35TSHRMEN1 | |
| SCHEMBL6703082 | 0.76 | TSHR (0.38) | ALDH1A1TSHRMEN1KMT2APTPN1 | |
| SCHEMBL9588964 | 0.76 | TSHR (0.42) | CTSDALDH1A1HTTTDP1TSHR | |
| SCHEMBL1035151 | 0.75 | PGK1 (0.39) | ALDH1A1TSHRMEN1KMT2APTPN1 | |
| SCHEMBL14524137 | 0.75 | NPSR1 (0.53) | NPSR1HSD17B10ALDH1A1HTTTDP1 |
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-105073117-A | Tricyclic heterocyclic compounds as anticancer agents | ICAHN SCHOOL MED MOUNT SINAI | 2015-11-18 | — | — | CN | disclosed |