Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.36 |
| ▸ | CA2 | P00918 | 4/20 | 0.36 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 3/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CCR3 | P51677 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL301932 | 0.86 | CNR1 (0.37) | CACNA1HCYP2D6KCNH2CNR1HTR1A | |
| SCHEMBL3559283 | 0.85 | RAB9A (0.44) | CA1CA2CNR1HTR1ADRD2 | |
| SCHEMBL301931 | 0.84 | CACNA1H (0.40) | CACNA1HCYP2D6KCNH2CNR1HTR1A | |
| SCHEMBL3557589 | 0.81 | CNR1 (0.38) | CA1CA2CACNA1HCYP2D6KCNH2 | |
| SCHEMBL3935356 | 0.81 | MAPT (0.39) | CACNA1HCYP2D6KCNH2CNR1HTR1A | |
| SCHEMBL3932204 | 0.80 | CNR1 (0.37) | CACNA1HCYP2D6KCNH2CNR1HTR1A | |
| SCHEMBL301835 | 0.74 | POLB (0.47) | CNR1MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL3563192 | 0.73 | KDM4E (0.46) | CA1CA2CNR1MAPTTP53 | |
| SCHEMBL302022 | 0.71 | CNR1 (0.40) | CA1CA2CNR1DRD2MAPT | |
| SCHEMBL3936618 | 0.71 | CNR1 (0.40) | CA1CA2CNR1DRD2MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4851328-B2 | — | — | 2012-01-11 | — | — | JP | claimed |
| JP-2007506692-A | — | — | 2007-03-22 | — | — | JP | claimed |
| EP-1670470-A1 | PYRIDINE DERIVATIVES AND USE THEREOF AS UROTENSIN II ANTAGONISTS | Actelion Pharmaceuticals Ltd. (CH) | 2006-06-21 | — | — | EP | claimed |
| WO-2005030209-A1 | PYRIDINE DERIVATIVES AND USE THEREOF AS UROTENSIN II ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2005-04-07 | — | — | WO | claimed |