Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TTR | P02766 | 1/20 | 0.32 |
| ▸ | ALB | P02768 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | COMT | P21964 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5822277 | 0.76 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2HPGDCTSD | |
| SCHEMBL4678996 | 0.76 | CTSD (0.51) | KMT2ACTSDALDH1A1LMNATDP1 | |
| SCHEMBL8760841 | 0.70 | KMT2A (0.38) | NPC1RAB9ASMN1; SMN2KMT2ACTSD | |
| SCHEMBL10685502 | 0.67 | GPR35 (0.41) | NPC1RAB9ASMN1; SMN2HPGDCTSD | |
| SCHEMBL28802121 | 0.66 | CRHBP (0.60) | ALDH1A1LMNATDP1TSHRMAPK1 | |
| SCHEMBL1962854 | 0.66 | GPR35 (0.55) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL11779921 | 0.66 | TDP1 (0.53) | KMT2AALDH1A1TDP1MEN1TTR | |
| SCHEMBL8070789 | 0.65 | ALDH1A1 (0.51) | KMT2ACTSDALDH1A1LMNATDP1 | |
| SCHEMBL2145662 | 0.65 | ALDH1A1 (0.50) | KMT2AALDH1A1LMNATDP1MEN1 | |
| SCHEMBL8635371 | 0.65 | HCAR3 (0.39) | SMN1; SMN2CTSDALDH1A1TDP1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5750782-A | ANTICARCINOGENIC AGENTS, ANTIHYPOXIC AGENTS, PRODRUGS | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |