Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TNF | P01375 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11615933 | 0.87 | RAB9A (0.43) | KDM4ETNFALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL11616351 | 0.85 | TNF (0.41) | KDM4ETNFALDH1A1TSHRNPSR1 | |
| SCHEMBL11621562 | 0.83 | ALDH1A1 (0.48) | KDM4EALDH1A1TSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL11614682 | 0.82 | TSHR (0.54) | KDM4EALDH1A1TSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL11617070 | 0.82 | ALDH1A1 (0.42) | KDM4EALDH1A1TSHRNPSR1HTT | |
| SCHEMBL11621082 | 0.80 | ALDH1A1 (0.41) | KDM4EALDH1A1TSHRNPSR1HTT | |
| SCHEMBL11613405 | 0.80 | ALDH1A1 (0.42) | KDM4EALDH1A1TSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL11613402 | 0.80 | ALDH1A1 (0.42) | KDM4EALDH1A1TSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL11621125 | 0.78 | LMNA (0.54) | KDM4EALDH1A1TSHRHTTSMN1; SMN2 | |
| SCHEMBL11613152 | 0.74 | FABP4 (0.47) | KDM4EHSD17B10CTNNB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4130649-A | Cyclohepta [B]pyridine-2-carboxylic acid derivatives | AYERST, MCKENNA & HARRISON LIMITED (CA) | 1978-12-19 | — | — | US | disclosed |