Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | FPR3 | P25089 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | RAD52 | P43351 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11507 | 0.82 | HRH3 (0.48) | SMN1; SMN2HRH3CYP2C9FPR3LMNA | |
| SCHEMBL20614282 | 0.81 | RAD52 (0.58) | SMN1; SMN2HRH3CYP2C9LMNARAD52 | |
| SCHEMBL7947655 | 0.81 | RAD52 (0.58) | SMN1; SMN2HRH3CYP2C9LMNARAD52 | |
| SCHEMBL6973435 | 0.79 | RAD52 (0.55) | SMN1; SMN2HRH3CYP2C9LMNARAD52 | |
| SCHEMBL11981495 | 0.79 | HRH3 (0.49) | SMN1; SMN2HRH3CYP2C9LMNARAD52 | |
| SCHEMBL18531871 | 0.78 | HRH3 (0.45) | SMN1; SMN2HRH3CYP2C9LMNARAD52 | |
| SCHEMBL4787562 | 0.77 | MEN1 (0.46) | HRH3LMNAEPHX1L3MBTL1MEN1 | |
| SCHEMBL6493217 | 0.76 | RAD52 (0.59) | SMN1; SMN2HRH3CYP2C9LMNARAD52 | |
| SCHEMBL6503351 | 0.76 | RAD52 (0.59) | SMN1; SMN2HRH3CYP2C9LMNARAD52 | |
| SCHEMBL17282197 | 0.76 | CYP1A2 (0.50) | SMN1; SMN2HRH3FPR3CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-9573962-B2 | Antimicrobial compounds and methods of making and using the same | MELINTA THERAPEUTICS, INC. (US) | 2017-02-21 | — | — | US | disclosed |
| WO-2011047320-A2 | ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | RIB-X PHARMACEUTICALS, INC. (US) | 2011-04-21 | — | — | WO | disclosed |