Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | NPBWR1 | P48145 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2856602 | 0.91 | RIPK1 (0.46) | MAPTABCB11P2RX7KMT2ATP53 | |
| SCHEMBL2850323 | 0.90 | MAPT (0.47) | NPC1RAB9AMAPTSMN1; SMN2NFKB1 | |
| SCHEMBL2853335 | 0.90 | TP53 (0.48) | NPC1RAB9AMAPTSMN1; SMN2NFKB1 | |
| SCHEMBL2857343 | 0.89 | P2RX7 (0.42) | MAPTSMN1; SMN2P2RX7KMT2ANPBWR1 | |
| SCHEMBL2853389 | 0.86 | NPC1 (0.62) | NPC1RAB9AMAPTSMN1; SMN2NFKB1 | |
| SCHEMBL2861643 | 0.84 | CNR1 (0.50) | NPC1RAB9ASMN1; SMN2GAATAAR1 | |
| SCHEMBL2860652 | 0.83 | POLB (0.44) | NPC1RAB9AMAPTSMN1; SMN2NFKB1 | |
| SCHEMBL2851589 | 0.82 | MTNR1A (0.48) | MAPTSMN1; SMN2KMT2ATP53ALDH1A1 | |
| SCHEMBL2854704 | 0.82 | P2RX7 (0.48) | MAPTSMN1; SMN2PKMP2RX7KMT2A | |
| SCHEMBL2856862 | 0.82 | NPC1 (0.53) | NPC1RAB9AMAPTSMN1; SMN2NFKB1 |
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-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |