Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | PDCD1 | Q15116 | 6/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 6/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5227634 | 0.96 | PDCD1 (0.40) | ALDH1A1LMNATP53SMN1; SMN2USP2 | |
| SCHEMBL5229335 | 0.88 | ALDH1A1 (0.42) | ALDH1A1LMNATP53SMN1; SMN2USP2 | |
| SCHEMBL5228047 | 0.86 | HTR2C (0.37) | ALDH1A1KDM4EGAA | |
| SCHEMBL5228505 | 0.84 | F10 (0.48) | — | |
| SCHEMBL5226838 | 0.84 | ALDH1A1 (0.41) | ALDH1A1LMNATP53SMN1; SMN2USP2 | |
| SCHEMBL5226166 | 0.84 | ALDH1A1 (0.41) | ALDH1A1LMNATP53SMN1; SMN2USP2 | |
| SCHEMBL5222920 | 0.84 | ALDH1A1 (0.41) | ALDH1A1LMNATP53SMN1; SMN2USP2 | |
| SCHEMBL5226663 | 0.84 | KMT2A (0.44) | ALDH1A1LMNATP53SMN1; SMN2USP2 | |
| SCHEMBL5226174 | 0.83 | ALDH1A1 (0.38) | ALDH1A1LMNATP53SMN1; SMN2USP2 | |
| SCHEMBL5228002 | 0.81 | TSHR (0.39) | ALDH1A1TP53SMN1; SMN2KDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |