Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6534717 | 0.98 | NOS1 (0.35) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL28373630 | 0.77 | NOS1 (0.35) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL27914618 | 0.73 | NOS1 (0.33) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL2330301 | 0.73 | NOS1 (0.33) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL5325391 | 0.73 | NOS1 (0.33) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL12027691 | 0.73 | CA1 (0.39) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL19008049 | 0.72 | NOS1 (0.38) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL2687921 | 0.72 | NOS1 (0.38) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL6534715 | 0.72 | GABRR1 (0.41) | — | |
| Water SCHEMBL27959235 | 0.71 | NOS1 (0.37) | NOS1NOS3NOS2CA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0941120-A4 | BRANCHED PEPTIDE LINKERS | BRISTOL MYERS SQUIBB CO (US) | 2004-08-18 | — | — | EP | disclosed |
| EP-0941120-A1 | BRANCHED PEPTIDE LINKERS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1999-09-15 | — | — | EP | disclosed |
| WO-1998019705-A1 | BRANCHED PEPTIDE LINKERS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-05-14 | — | — | WO | disclosed |