Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.36 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 2/20 | 0.30 |
| ▸ | CA5A | P35218 | 2/20 | 0.30 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 1/20 | 0.30 |
| ▸ | CA6 | P23280 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19170305 | 0.83 | CA2 (0.34) | CA2TSHRTP53EGLN1EGLN3 | |
| SCHEMBL14157935 | 0.82 | CA2 (0.50) | CA2ALDH1A1POLBSMN1; SMN2MEN1 | |
| SCHEMBL5485794 | 0.73 | CA2 (0.42) | CA2ALDH1A1POLBSMN1; SMN2MEN1 | |
| SCHEMBL16330338 | 0.73 | CA2 (0.42) | CA2ALDH1A1POLBSMN1; SMN2MEN1 | |
| SCHEMBL18956906 | 0.72 | — | — | |
| SCHEMBL1274398 | 0.72 | — | — | |
| SCHEMBL1871042 | 0.72 | — | — | |
| SCHEMBL2835693 | 0.71 | ALDH1A1 (0.44) | CA2ALDH1A1POLBSMN1; SMN2MEN1 | |
| SCHEMBL18044384 | 0.71 | — | — | |
| SCHEMBL555475 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003084935-A2 | DIARYL PYRIMIDINONE DERIVATIVES USEFUL FOR THE TREATMENT OF INFLAMMATION AND IMMUNOGOLICAL DISEASES | ORCHID CHEMICALS & PHARMACEUTICALS LTD (IN) | 2003-10-16 | — | — | WO | disclosed |
| US-5200526-A | Syntheses of optically pure α-amino acids from 3-amino-2-oxetanone salts | THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) | 1993-04-06 | — | — | US | disclosed |