Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | MMP2 | P08253 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 5/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 5/20 | 0.58 |
| ▸ | POLB | P06746 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | DDX3X | O00571 | 1/20 | 0.58 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.52 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3972854 | 0.85 | KMT2A (0.63) | CA12CA1MMP2MEN1KMT2A | |
| SCHEMBL15994785 | 0.82 | SMN1; SMN2 (0.59) | CA12CA1MMP2MEN1KMT2A | |
| SCHEMBL9706333 | 0.82 | SMN1; SMN2 (0.59) | CA12CA1MMP2MEN1KMT2A | |
| SCHEMBL8549299 | 0.82 | CA12 (0.58) | CA12CA1MMP2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL10523672 | 0.81 | SMN1; SMN2 (0.57) | CA12CA1MMP2MEN1KMT2A | |
| SCHEMBL11198274 | 0.79 | SMN1; SMN2 (0.56) | CA12CA1MMP2MEN1KMT2A | |
| SCHEMBL7582132 | 0.79 | ALDH1A1 (0.57) | CA12CA1MMP2MEN1KMT2A | |
| SCHEMBL11198273 | 0.79 | SMN1; SMN2 (0.56) | CA12CA1MMP2MEN1KMT2A | |
| SCHEMBL8977462 | 0.78 | ALDH1A1 (0.60) | CA12CA1MMP2MEN1KMT2A | |
| SCHEMBL27964933 | 0.77 | KMT2A (0.69) | MEN1KMT2AMAPTPOLBHTT |
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-2004065389-A1 | PYRROLOPYRIMIDINE DERIVATIVES USEFUL AS MODULATORS OF MULTIDRUG RESISTANCE | XENOVA LIMITED (GB) | 2004-08-05 | — | — | WO | disclosed |