Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Pyrimidine SCHEMBL28845436 | 0.85 | NCF1 (0.60) | NCF1LMNANR4A2CYP3A4KMT2A | |
| 8-Aminoquinoline SCHEMBL860459 | 0.84 | LMNA (0.53) | NCF1LMNANR4A2CYP3A4KMT2A | |
| Quinolin-4-Amine SCHEMBL15270685 | 0.84 | NCF1 (0.81) | NCF1LMNANR4A2KMT2AHSP90AA1 | |
| 8-Aminoquinoline SCHEMBL28078884 | 0.79 | ALDH1A1 (0.63) | NCF1LMNACYP3A4KMT2AHSP90AA1 | |
| Quinolin-4-Amine SCHEMBL27779896 | 0.79 | NCF1 (0.78) | NCF1LMNANR4A2CYP3A4KMT2A | |
| Quinolin-4-Amine SCHEMBL28330234 | 0.79 | NCF1 (0.84) | NCF1LMNANR4A2KMT2AHSP90AA1 | |
| SCHEMBL29961464 | 0.77 | NCF1 (0.72) | NCF1LMNANR4A2CYP3A4KMT2A | |
| SCHEMBL115674 | 0.77 | NCF1 (0.72) | NCF1LMNANR4A2CYP3A4KMT2A | |
| Hydrochloric Acid SCHEMBL6119015 | 0.75 | NCF1 (0.69) | NCF1LMNANR4A2CYP3A4KMT2A | |
| Hydrochloric Acid SCHEMBL29862816 | 0.75 | NCF1 (0.69) | NCF1LMNANR4A2CYP3A4KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1073891-A2 | METHOD OF PREDICITING RECEPTOR MODULATING ACTIVITY | Karo Bio USA, Inc. (US) | 2001-02-07 | — | — | EP | disclosed |
| WO-1999054728-A2 | METHOD OF PREDICTING RECEPTOR MODULATING ACTIVITY | KARO BIO USA, INC. (US) | 1999-10-28 | — | — | WO | disclosed |