Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | G6PD | P11413 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 5/20 | 0.40 |
| ▸ | CYBB | P04839 | 1/20 | 0.40 |
| ▸ | NOX5 | Q96PH1 | 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 | |
|---|---|---|---|---|
| SCHEMBL3936646 | 0.96 | ALDH1A1 (0.53) | ALDH1A1KMT2APTK2BKDM4ELMNA | |
| SCHEMBL6042573 | 0.85 | ALDH1A1 (0.84) | ALDH1A1KMT2APTK2BKDM4ELMNA | |
| SCHEMBL25788066 | 0.85 | ALDH1A1 (0.84) | ALDH1A1KMT2APTK2BKDM4ELMNA | |
| SCHEMBL7502135 | 0.83 | TSHR (0.49) | ALDH1A1KMT2APTK2BKDM4ELMNA | |
| SCHEMBL7773567 | 0.82 | KMT2A (0.50) | ALDH1A1KMT2APTK2BKDM4ELMNA | |
| SCHEMBL9348401 | 0.82 | G6PD (0.47) | ALDH1A1KMT2APTK2BKDM4EG6PD | |
| SCHEMBL25438784 | 0.81 | KMT2A (0.54) | ALDH1A1KMT2APTK2BKDM4ELMNA | |
| SCHEMBL1505142 | 0.80 | ALDH1A1 (0.74) | ALDH1A1KMT2APTK2BKDM4ELMNA | |
| SCHEMBL26355092 | 0.79 | ALDH1A1 (0.73) | ALDH1A1KMT2APTK2BKDM4ELMNA | |
| SCHEMBL23352277 | 0.79 | CYP1A2 (0.44) | KDM4ELMNASMN1; SMN2MAPTNCF1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1124788-A4 | BIS(HALOETHYL)AMINOBENZENE DERIVATIVES | SHIONOGI BIORES CORP (US) | 2002-11-06 | — | — | EP | disclosed |
| EP-1124788-A2 | BIS(HALOETHYL)AMINOBENZENE DERIVATIVES | Shionogi Bioresearch Corporation (US) | 2001-08-22 | — | — | EP | disclosed |
| WO-2000024361-A2 | BIS(HALOETHYL)AMINOBENZENE DERIVATIVES | SHIONOGI BIORESEARCH CORP. (US) | 2000-05-04 | — | — | WO | disclosed |