Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 10/20 | 0.45 |
| ▸ | HTR2C | P28335 | 10/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19365744 | 0.88 | ABL1 (0.43) | TSHRHTR2AHTR2CTP53MAPT | |
| SCHEMBL19365254 | 0.88 | HTR2C (0.47) | TSHRHTR2AHTR2CTP53MAPT | |
| SCHEMBL19670359 | 0.87 | CLK2 (0.40) | TSHRTP53MAPTSMN1; SMN2GAA | |
| SCHEMBL19365620 | 0.87 | HTR2C (0.43) | TSHRHTR2AHTR2CTP53MAPT | |
| SCHEMBL19865071 | 0.85 | HTR2C (0.47) | TSHRHTR2AHTR2CTP53MAPT | |
| SCHEMBL16238463 | 0.84 | TSHR (0.47) | TSHRHTR2AHTR2CTP53MAPT | |
| SCHEMBL19365498 | 0.83 | HTR2C (0.46) | TSHRHTR2AHTR2CTP53MAPT | |
| SCHEMBL17618428 | 0.82 | TSHR (0.46) | TSHRHTR2AHTR2CTP53MAPT | |
| SCHEMBL19670228 | 0.82 | NPC1 (0.38) | TSHRMAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL19365530 | 0.81 | NAMPT (0.47) | TSHRHTR2AHTR2CTP53MAPT |
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-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |