Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.64 |
| ▸ | MEN1 | O00255 | 7/20 | 0.64 |
| ▸ | MAPT | P10636 | 5/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.64 |
| ▸ | HTT | P42858 | 2/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.64 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6279104 | 0.89 | ALDH1A1 (0.70) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL6281848 | 0.87 | ALDH1A1 (0.65) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL6278157 | 0.87 | KMT2A (0.66) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL6278099 | 0.85 | ALDH1A1 (0.65) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL13547675 | 0.82 | ALDH1A1 (0.76) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL1702494 | 0.81 | ALDH1A1 (0.64) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL6278534 | 0.80 | ALDH1A1 (0.65) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL6277599 | 0.80 | ALDH1A1 (0.65) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL6274384 | 0.79 | ALDH1A1 (0.64) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL6274361 | 0.78 | ALDH1A1 (0.70) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 |
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-2005115147-A2 | HIV REVERSE TRANSCRIPTASE INHIBITORS | MERCK & CO., INC. (US) | 2005-12-08 | — | — | WO | disclosed |