Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11244962 | 0.86 | CA12 (0.57) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL3879200 | 0.84 | ATM (0.49) | ATML3MBTL1CYP1A2CYP2D6PKM | |
| SCHEMBL16732235 | 0.82 | L3MBTL1 (0.46) | ATML3MBTL1CYP1A2CYP2D6PKM | |
| SCHEMBL322084 | 0.81 | ALOX15 (0.42) | ATML3MBTL1CYP1A2CYP2D6MTNR1A | |
| SCHEMBL1790169 | 0.81 | ALDH1A1 (0.55) | CA2ATML3MBTL1CYP1A2CYP2D6 | |
| SCHEMBL575633 | 0.81 | ATM (0.41) | ATML3MBTL1CYP1A2CYP2D6PKM | |
| SCHEMBL13599587 | 0.80 | ALOX15 (0.41) | ATML3MBTL1CYP1A2MTNR1AMTNR1B | |
| SCHEMBL16732074 | 0.79 | ATM (0.44) | ATML3MBTL1CYP1A2CYP2D6PKM | |
| SCHEMBL16732234 | 0.79 | FFAR1 (0.44) | ATML3MBTL1CYP1A2FFAR1MAPT | |
| SCHEMBL10836796 | 0.79 | MTNR1A (0.45) | ATML3MBTL1CYP1A2CYP2D6MTNR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0441226-A1 | (cyanomethyl)pyridines useful as PAF antagonists | J. URIACH & CIA. S.A. (ES) | 1991-08-14 | — | — | EP | disclosed |