Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | MMP8 | P22894 | 2/20 | 0.62 |
| ▸ | RECQL | P46063 | 1/20 | 0.62 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.53 |
| ▸ | PPID | Q08752 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1439605 | 0.90 | ALDH1A1 (0.52) | ALDH1A1MMP8RECQLPIN1TSHR | |
| SCHEMBL1437759 | 0.87 | NPC1 (0.52) | ALDH1A1MMP8RECQLPIN1SMN1; SMN2 | |
| SCHEMBL3472271 | 0.86 | MMP8 (0.52) | ALDH1A1MMP8RECQLPIN1POLB | |
| SCHEMBL3472275 | 0.86 | MMP8 (0.52) | ALDH1A1MMP8RECQLPIN1POLB | |
| SCHEMBL4419400 | 0.85 | ALDH1A1 (0.62) | ALDH1A1MMP8RECQLPIN1PPID | |
| SCHEMBL14210007 | 0.85 | ALDH1A1 (0.53) | ALDH1A1MMP8RECQLSMN1; SMN2LMNA | |
| SCHEMBL8710582 | 0.84 | MMP8 (0.79) | ALDH1A1MMP8RECQLPIN1PPID | |
| SCHEMBL8661661 | 0.84 | MMP8 (0.60) | ALDH1A1MMP8RECQLPIN1PPID | |
| SCHEMBL1492859 | 0.84 | MMP8 (0.65) | ALDH1A1MMP8RECQLPIN1PPID | |
| SCHEMBL30513307 | 0.84 | ALDH1A1 (0.60) | ALDH1A1MMP8RECQLPIN1PPID |
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-2006117800-A2 | NOVEL 3, 4-PROPYLENEDIOXYTHIOPHENE DERIVATIVES WITH PENDANT FUNCTIONAL GROUPS | INDIAN INSTITUTE OF TECHNOLOGY BOMBAY (IN) | 2006-11-09 | — | — | WO | disclosed |