Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 11/20 | 0.47 |
| ▸ | F2 | P00734 | 2/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.43 |
| ▸ | CPA1 | P15085 | 1/20 | 0.42 |
| ▸ | CPA2 | P48052 | 1/20 | 0.42 |
| ▸ | CPA4 | Q9UI42 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7207593 | 0.85 | FKBP1A (0.48) | FKBP1AF2PIN1CTSLCTSK | |
| SCHEMBL1980413 | 0.84 | CTSC (0.55) | CTSK | |
| SCHEMBL1980119 | 0.83 | DPP4 (0.45) | — | |
| SCHEMBL13938202 | 0.83 | FKBP1A (0.46) | FKBP1AF2PIN1CTSLCTSK | |
| SCHEMBL1978336 | 0.82 | ITGB3 (0.47) | — | |
| SCHEMBL7775137 | 0.81 | CTSC (0.59) | — | |
| SCHEMBL1979768 | 0.80 | FKBP1A (0.52) | FKBP1AF2PIN1CTSLCTSK | |
| SCHEMBL1979169 | 0.80 | FKBP1A (0.55) | FKBP1AF2PIN1CTSLCTSK | |
| SCHEMBL14906688 | 0.78 | ALDH1A1 (0.48) | F2CTRB1 | |
| SCHEMBL14906683 | 0.78 | ALDH1A1 (0.48) | F2CTRB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1326834-B1 | 2-SUBSTITUTED HETEROCYCLIC COMPOUNDS | H LEE MOFFITT CANCER CT & RES (US) | 2011-06-29 | — | — | EP | disclosed |
| EP-1326834-B1 | 2-SUBSTITUTED HETEROCYCLIC COMPOUNDS | H LEE MOFFITT CANCER CT & RES (US) | 2011-06-29 | — | — | EP | disclosed |