Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL21478274 | 0.75 | SLC6A3 (0.39) | ALDH1A1KDM4EHPGDMAPTSLC6A3 | |
| SCHEMBL21474596 | 0.71 | LTB4R (0.42) | NPSR1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL21474683 | 0.68 | MAOB (0.40) | TSHRALDH1A1MAPTSLC6A3MEN1 | |
| SCHEMBL21474591 | 0.65 | ACHE (0.38) | SLC6A3MEN1KMT2AMAPK1RAB9A | |
| SCHEMBL21478276 | 0.65 | FFAR1 (0.39) | TSHRSLC6A3LTB4RLTB4R2 | |
| SCHEMBL21478273 | 0.64 | SLC6A3 (0.42) | ALDH1A1KDM4EGAAHPGDCASP1 | |
| SCHEMBL4363906 | 0.64 | ABL1 (0.62) | TSHRALDH1A1KDM4EMAPTSLC6A3 | |
| SCHEMBL4946520 | 0.64 | S1PR4 (0.62) | ALDH1A1KDM4EMAPTNPSR1S1PR4 | |
| SCHEMBL11300844 | 0.63 | ABL1 (0.61) | TSHRALDH1A1KDM4EMAPTSLC6A3 | |
| SCHEMBL21478254 | 0.63 | MAOB (0.39) | TSHRMAPTSLC6A3MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019199979-A1 | ANTIBACTERIAL COMPOUNDS | THE GENERAL HOSPITAL CORPORATION (US) | 2019-10-17 | — | — | WO | disclosed |