Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | SYK | P43405 | 1/20 | 0.54 |
| ▸ | CTSS | P25774 | 5/20 | 0.52 |
| ▸ | CTSK | P43235 | 4/20 | 0.52 |
| ▸ | CTSB | P07858 | 2/20 | 0.52 |
| ▸ | CTSL | P07711 | 1/20 | 0.52 |
| ▸ | ACE | P12821 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | AKT1 | P31749 | 3/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13109024 | 0.89 | ATM (0.54) | ATMSYKCTSSCTSKCTSB | |
| SCHEMBL6835510 | 0.89 | ATM (0.54) | ATMSYKCTSSCTSKCTSB | |
| SCHEMBL12295159 | 0.88 | ATM (0.53) | ATMSYKCTSSCTSKCTSB | |
| SCHEMBL6874791 | 0.88 | ATM (0.53) | ATMSYKCTSSCTSKCTSB | |
| SCHEMBL18748463 | 0.88 | ATM (0.53) | ATMSYKCTSSCTSKCTSB | |
| SCHEMBL21609299 | 0.88 | ATM (0.53) | ATMSYKCTSSCTSKCTSB | |
| SCHEMBL12295162 | 0.86 | CTSS (0.50) | ATMSYKCTSSCTSKCTSB | |
| SCHEMBL12166523 | 0.85 | ATM (0.51) | ATMSYKCTSSCTSKCTSB | |
| SCHEMBL6874903 | 0.84 | SYK (0.50) | ATMSYKCTSSCTSKCTSB | |
| SCHEMBL18748451 | 0.84 | SYK (0.50) | ATMSYKCTSSCTSKCTSB |
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-4720585-A | 2-MERCAPTOPROPANEDIAMINES | E. R. SQUIBB & SONS, INC. | 1988-01-19 | — | — | US | disclosed |