Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 18/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TRPC1 | P48995 | 1/20 | 0.35 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.35 |
| ▸ | STIM1 | Q13586 | 1/20 | 0.35 |
| ▸ | ORAI1 | Q96D31 | 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 | |
|---|---|---|---|---|
| SCHEMBL7561296 | 0.87 | ALDH1A1 (0.33) | ALDH1A1POLBNPSR1TRPC1TRPC3 | |
| SCHEMBL38910 | 0.87 | ALDH1A1 (0.33) | ALDH1A1POLBNPSR1TRPC1TRPC3 | |
| SCHEMBL30750946 | 0.87 | ALDH1A1 (0.33) | ALDH1A1POLBNPSR1TRPC1TRPC3 | |
| Pyrazon SCHEMBL7582671 | 0.82 | TRPC1 (0.35) | NTRK1TRPC1TRPC3STIM1ORAI1 | |
| Clopyralid SCHEMBL7589112 | 0.82 | RIPK1 (0.34) | ALDH1A1HSD17B10TRPC1TRPC3STIM1 | |
| Metazachlor SCHEMBL7583846 | 0.80 | — | — | |
| Difenzoquat SCHEMBL7579558 | 0.80 | TP53 (0.34) | NTRK1TRPC1TRPC3STIM1ORAI1 | |
| Tebutam SCHEMBL7580831 | 0.80 | MEN1 (0.34) | NTRK1ALDH1A1POLBTSHRNPSR1 | |
| SCHEMBL7581102 | 0.79 | CYP3A4 (0.33) | NTRK1ALDH1A1 | |
| SCHEMBL27320851 | 0.79 | MAPT (0.34) | NTRK1ALDH1A1 |
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-2002057989-A2 | METHOD FOR METABOLIC PROFILING | BASF AKTIENGESELLSCHAFT (DE) | 2002-07-25 | — | — | WO | disclosed |