Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.59 |
| ▸ | CA2 | P00918 | 1/20 | 0.59 |
| ▸ | CA9 | Q16790 | 1/20 | 0.59 |
| ▸ | SIRT2 | Q8IXJ6 | 12/20 | 0.58 |
| ▸ | SIRT1 | Q96EB6 | 12/20 | 0.58 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL17826584 | 0.88 | MEN1 (0.65) | ALDH1A1NPC1RAB9ASIRT2SIRT1 | |
| SCHEMBL17826597 | 0.88 | SIRT2 (0.73) | EPHX1SIRT2SIRT1SIRT3 | |
| SCHEMBL16229381 | 0.88 | SIRT1 (0.67) | ALDH1A1NPC1RAB9AEPHX1NPSR1 | |
| SCHEMBL17826576 | 0.88 | POLB (0.64) | ALDH1A1NPC1RAB9AEPHX1NPSR1 | |
| SCHEMBL17826575 | 0.87 | SIRT2 (0.75) | SIRT2SIRT1SIRT3 | |
| SCHEMBL17826598 | 0.87 | SIRT2 (0.77) | SIRT2SIRT1SIRT3MAPT | |
| SCHEMBL17826580 | 0.86 | SMN1; SMN2 (0.59) | ALDH1A1NPC1RAB9ASIRT2SIRT1 | |
| SCHEMBL17826589 | 0.86 | SIRT1 (0.60) | SIRT2SIRT1SIRT3 | |
| SCHEMBL17826588 | 0.85 | SIRT2 (0.63) | SIRT2SIRT1SIRT3 | |
| SCHEMBL17826586 | 0.85 | SIRT2 (0.77) | ALDH1A1CA1CA2CA9SIRT2 |
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-9365508-B2 | Aroyl thiourea derivatives | UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) | 2016-06-14 | — | — | US | disclosed |