Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLLT1 | Q03111 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | GHSR | Q92847 | 7/20 | 0.34 |
| ▸ | F10 | P00742 | 6/20 | 0.33 |
| ▸ | F2 | P00734 | 2/20 | 0.33 |
| ▸ | PYGL | P06737 | 2/20 | 0.33 |
| ▸ | TACR1 | P25103 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6832182 | 1.00 | MLLT1 (0.36) | MLLT1CTSSCTSKGHSRF10 | |
| SCHEMBL6838615 | 0.84 | MLLT1 (0.40) | MLLT1CTSSCTSKGHSRPYGL | |
| SCHEMBL5255124 | 0.84 | MLLT1 (0.40) | MLLT1CTSSCTSKGHSRPYGL | |
| SCHEMBL6838618 | 0.84 | MLLT1 (0.40) | MLLT1CTSSCTSKGHSRPYGL | |
| SCHEMBL6839388 | 0.83 | MLLT1 (0.42) | MLLT1CTSSCTSKGHSRF10 | |
| SCHEMBL5254556 | 0.83 | MLLT1 (0.42) | MLLT1CTSSCTSKGHSRF10 | |
| SCHEMBL6838498 | 0.83 | MLLT1 (0.56) | MLLT1CTSKGHSRPYGL | |
| SCHEMBL5254519 | 0.83 | MLLT1 (0.56) | MLLT1CTSKGHSRPYGL | |
| SCHEMBL5257174 | 0.83 | MLLT1 (0.41) | MLLT1CTSSCTSKF10PYGL | |
| SCHEMBL5259539 | 0.83 | SMYD3 (0.48) | F10F2PYGL |
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-6747053-B2 | Heteroaryl nitriles | ROCHE PALO ALTO LLC | 2004-06-08 | — | — | US | disclosed |