Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | LPO | P22079 | 2/20 | 0.39 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8688601 | 0.87 | KDM4E (0.38) | NR4A2BRD4CA12CA1CA2 | |
| SCHEMBL369006 | 0.83 | NR4A2 (0.42) | NR4A2BRD4CA12CA1CA2 | |
| SCHEMBL14248980 | 0.82 | KDM4E (0.36) | CA12CA1CA2CA9KDM4E | |
| SCHEMBL3576948 | 0.82 | CA12 (0.36) | NR4A2BRD4CA12CA1CA2 | |
| SCHEMBL7883971 | 0.81 | KDM4E (0.34) | NR4A2CA12CA1CA2CA9 | |
| SCHEMBL874860 | 0.80 | GPR35 (0.38) | CA12CA1CA2CA9LPO | |
| SCHEMBL20562638 | 0.79 | NR4A2 (0.42) | NR4A2BRD4CA12CA1CA2 | |
| SCHEMBL12852551 | 0.78 | NR4A2 (0.41) | NR4A2BRD4CA12CA1CA2 | |
| SCHEMBL29191083 | 0.78 | NR4A2 (0.41) | NR4A2BRD4CA12CA1CA2 | |
| SCHEMBL16320824 | 0.77 | ALDH1A1 (0.42) | NR4A2BRD4CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012038904-A1 | NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-03-29 | — | — | WO | disclosed |