Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | WNT3A | P56704 | 1/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.34 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14843212 | 0.83 | SMN1; SMN2 (0.45) | ALDH1A1HPGDSMN1; SMN2KMT2AMAPT | |
| SCHEMBL9880004 | 0.75 | ALDH1A1 (0.36) | ALDH1A1HPGDSMN1; SMN2HSD17B10HTT | |
| SCHEMBL7417121 | 0.74 | SMN1; SMN2 (0.46) | HPGDSMN1; SMN2PARP1TNKSWNT3A | |
| SCHEMBL1033870 | 0.72 | HPGD (0.49) | ALDH1A1HPGDHTTKMT2AMAPT | |
| SCHEMBL7776875 | 0.70 | TNKS (0.59) | ALDH1A1HPGDSMN1; SMN2PARP1TNKS | |
| SCHEMBL9878958 | 0.69 | HPGD (0.57) | ALDH1A1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL18689663 | 0.69 | HPGD (0.61) | ALDH1A1HPGDMAPTTSHRMAPK1 | |
| SCHEMBL7784771 | 0.68 | PARP1 (0.50) | ALDH1A1HPGDSMN1; SMN2PARP1TNKS | |
| SCHEMBL18689739 | 0.67 | SPR (0.42) | ALDH1A1HPGDHTTKMT2AMAPT | |
| SCHEMBL4738751 | 0.66 | ALDH1A1 (0.53) | ALDH1A1HPGDSMN1; SMN2PARP1TNKS |
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-1991018887-A1 | DIAMINOPYRIMIDINE COMPOUNDS | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1991-12-12 | — | — | WO | disclosed |