Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.80 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.64 |
| ▸ | POLB | P06746 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | TP53 | P04637 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29514448 | 0.82 | KDM4E (0.59) | TSHRKDM4EKMT2AMEN1POLB | |
| SCHEMBL28227385 | 0.77 | TSHR (0.71) | TSHRKDM4EKMT2AMEN1POLB | |
| SCHEMBL11312445 | 0.72 | KDM4E (0.57) | TSHRKDM4EKMT2AMEN1POLB | |
| SCHEMBL14716724 | 0.70 | KDM4E (0.68) | TSHRKDM4EKMT2AMEN1POLB | |
| SCHEMBL29635245 | 0.70 | KDM4E (0.68) | TSHRKDM4EKMT2AMEN1POLB | |
| SCHEMBL31156476 | 0.69 | TSHR (0.58) | TSHRKDM4EKMT2AMEN1POLB | |
| SCHEMBL31671076 | 0.69 | TSHR (0.58) | TSHRKDM4EKMT2AMEN1POLB | |
| SCHEMBL15931704 | 0.69 | TSHR (0.58) | TSHRKDM4EKMT2AMEN1POLB | |
| SCHEMBL31156517 | 0.68 | TSHR (0.57) | TSHRKDM4EKMT2AMEN1POLB | |
| SCHEMBL31156510 | 0.68 | TSHR (0.57) | TSHRKDM4EKMT2AMEN1POLB |
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-1474147-B1 | PYRIMIDINE-BASED COMPOUNDS USEFUL AS GSK-3 INHIBITORS | VERTEX PHARMA (US) | 2010-05-05 | — | — | EP | disclosed |