Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 8/20 | 0.40 |
| ▸ | POLB | P06746 | 5/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.40 |
| ▸ | CTSL | P07711 | 2/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 10/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NPR3 | P17342 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9401786 | 1.00 | NPSR1 (0.40) | NPSR1POLBTDP1CTSLCTSB | |
| SCHEMBL9401927 | 0.82 | BTN3A1 (0.36) | NPSR1POLBCTSKMAPTKMT2A | |
| SCHEMBL10445511 | 0.82 | BTN3A1 (0.36) | NPSR1POLBCTSKMAPTKMT2A | |
| SCHEMBL9401730 | 0.82 | BTN3A1 (0.36) | NPSR1POLBCTSKMAPTKMT2A | |
| SCHEMBL7377349 | 0.79 | CTSK (0.38) | CTSLCTSBCTSSCTSKNPR3 | |
| SCHEMBL7376784 | 0.79 | CTSK (0.38) | CTSLCTSBCTSSCTSKNPR3 | |
| SCHEMBL10445498 | 0.79 | CTSK (0.38) | CTSLCTSBCTSSCTSKNPR3 | |
| SCHEMBL9401661 | 0.78 | CTSK (0.31) | CTSSCTSKKMT2AMEN1GAA | |
| SCHEMBL9401629 | 0.78 | CTSK (0.31) | CTSSCTSKKMT2AMEN1GAA | |
| SCHEMBL9401662 | 0.78 | ITGA4 (0.58) | NPSR1POLBTDP1CTSLCTSB |
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 |
|---|---|---|---|---|---|---|---|
| US-5286869-A | Vasodilators and anticoagulants | FUJIREBIO KABUSHIKI KAISHA (JP) | 1994-02-15 | — | — | US | disclosed |
| EP-0403957-A2 | Optical active 1,4-dihydropyridine derivates | FUJIREBIO INC. (JP) | 1990-12-27 | — | — | EP | disclosed |