Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | NQO2 | P16083 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6274930 | 0.80 | TSHR (0.46) | POLBTSHRHPGDKDM4EALDH1A1 | |
| SCHEMBL7081653 | 0.77 | ACACA (0.42) | POLBMEN1KMT2AMAPTTSHR | |
| SCHEMBL23069187 | 0.77 | GRM2 (0.32) | — | |
| SCHEMBL23069165 | 0.77 | SCN9A (0.30) | — | |
| SCHEMBL23069196 | 0.77 | ACP1 (0.36) | MEN1KMT2AMAPTSMN1; SMN2HPGD | |
| SCHEMBL23069199 | 0.75 | IRAK4 (0.32) | KMT2AMAPTKDM4E | |
| SCHEMBL23069194 | 0.74 | ALDH1A1 (0.39) | POLBLMNAKDM4EALDH1A1RAB9A | |
| SCHEMBL5251836 | 0.74 | DCPS (0.47) | POLBMEN1KMT2AMAPTTSHR | |
| SCHEMBL857662 | 0.74 | LMNA (0.39) | POLBMEN1KMT2AMAPTLMNA | |
| SCHEMBL4767346 | 0.73 | TOP2A (0.50) | POLBKMT2ASMN1; SMN2KDM4EALDH1A1 |
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-6268514-B1 | TREATING INDUSTRIAL MATERIALS WITH NITROETHANE COMPOUND FOR PROTECTING AGAINST ATTACK AND DESTRUCTION BY MICROORGANISMS | BASF AKTIENGESELLSCHAFT (DE) | 2001-07-31 | — | — | US | disclosed |