Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CCR1 | P32246 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 0.47 |
| ▸ | CCR8 | P51685 | 1/20 | 0.47 |
| ▸ | METAP1 | P53582 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.47 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.47 |
| ▸ | NCF1 | P14598 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4015315 | 0.96 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTPOLBLMNA | |
| SCHEMBL27982719 | 0.93 | ALDH1A1 (0.63) | ALDH1A1KDM4EMAPTPOLBLMNA | |
| Quinoxaline SCHEMBL28227545 | 0.90 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTPOLBLMNA | |
| Iodide SCHEMBL10806172 | 0.90 | ALDH1A1 (0.60) | ALDH1A1KDM4EMAPTPOLBLMNA | |
| Quinoxaline SCHEMBL5315 | 0.89 | ALDH1A1 (0.58) | ALDH1A1KDM4EMAPTPOLBLMNA | |
| SCHEMBL30099834 | 0.89 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTPOLBLMNA | |
| Quinoxaline SCHEMBL6928518 | 0.89 | ALDH1A1 (0.58) | ALDH1A1KDM4EMAPTPOLBLMNA | |
| Quinoxaline SCHEMBL29355228 | 0.89 | ALDH1A1 (0.58) | ALDH1A1KDM4EMAPTPOLBLMNA | |
| Quinoxaline SCHEMBL30320908 | 0.89 | ALDH1A1 (0.58) | ALDH1A1KDM4EMAPTPOLBLMNA | |
| SCHEMBL8194 | 0.89 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTPOLBLMNA |
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-0108181-B1 | DIBENZO(B,I)-1,4,8,11-TETRAAZA(14)ANNULENOCOBALT(III) IODIDE | CIBA-GEIGY AG (CH) | 1987-04-29 | — | — | EP | claimed |
| EP-0670832-B1 | HEPATOBILIARY MAGNETIC RESONANCE CONTRAST AGENTS | BRACCO INT BV (NL) | 2002-06-05 | — | — | EP | disclosed |
| EP-0108181-B1 | DIBENZO(B,I)-1,4,8,11-TETRAAZA(14)ANNULENOCOBALT(III) IODIDE | CIBA-GEIGY AG (CH) | 1987-04-29 | — | — | EP | disclosed |