Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | PTPRB | P23467 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | GLS | O94925 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16587895 | 1.00 | KMT2A (0.42) | KMT2ATRPA1TSHRHSD17B10PTPRB | |
| SCHEMBL15240604 | 0.84 | KMT2A (0.41) | KMT2ATRPA1TSHRHSD17B10PTPRB | |
| SCHEMBL2408679 | 0.83 | HCAR2 (0.41) | KMT2ATRPA1TSHRHSD17B10PTPRB | |
| SCHEMBL2406309 | 0.82 | KMT2A (0.40) | KMT2ATRPA1TSHRHSD17B10PTPRB | |
| SCHEMBL2412304 | 0.82 | KMT2A (0.40) | KMT2ATRPA1TSHRHSD17B10PTPRB | |
| SCHEMBL11899820 | 0.80 | MEN1 (0.41) | KMT2AALDH1A1 | |
| SCHEMBL19962263 | 0.77 | KMT2A (0.47) | KMT2ATSHRHSD17B10ABCB1CA1 | |
| SCHEMBL3055857 | 0.75 | ALOX12 (0.45) | KMT2ATRPA1TSHRHSD17B10ABCB1 | |
| SCHEMBL13135986 | 0.75 | PTPRB (0.42) | KMT2ATRPA1TSHRHSD17B10PTPRB | |
| SCHEMBL2862909 | 0.75 | PTPRB (0.42) | KMT2ATRPA1TSHRHSD17B10PTPRB |
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-2011053542-A1 | HETEROCYCLE AMIDE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-05-05 | — | — | WO | disclosed |