Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CCR4 | P51679 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 2/20 | 0.48 |
| ▸ | MMP9 | P14780 | 2/20 | 0.48 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP12 | P39900 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14010454 | 0.89 | KMT2A (0.47) | ALDH1A1HTTCCR4KMT2AMMP2 | |
| SCHEMBL13814477 | 0.85 | ALDH1A1 (0.64) | ALDH1A1HTTKDM4EHSD17B10POLB | |
| SCHEMBL3791791 | 0.85 | ALDH1A1 (0.64) | ALDH1A1HTTKDM4EHSD17B10POLB | |
| SCHEMBL12509430 | 0.83 | FKBP1A (0.64) | ALDH1A1HTTKDM4EHSD17B10POLB | |
| SCHEMBL2706429 | 0.81 | ALDH1A1 (0.68) | ALDH1A1HTTKDM4EHSD17B10POLB | |
| SCHEMBL696506 | 0.81 | ALDH1A1 (0.68) | ALDH1A1HTTKDM4EHSD17B10POLB | |
| SCHEMBL2636629 | 0.81 | ALDH1A1 (0.68) | ALDH1A1HTTKDM4EHSD17B10POLB | |
| SCHEMBL2706426 | 0.81 | ALDH1A1 (0.68) | ALDH1A1HTTKDM4EHSD17B10POLB | |
| SCHEMBL696505 | 0.81 | ALDH1A1 (0.68) | ALDH1A1HTTKDM4EHSD17B10POLB | |
| SCHEMBL2705858 | 0.81 | ALDH1A1 (0.61) | ALDH1A1HTTKDM4EHSD17B10POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-7956052-B2 | Modulators of ATP-binding cassette transporters | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-06-07 | — | — | US | disclosed |