Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4850388 | 1.00 | ALDH1A1 (0.40) | ALDH1A1HTTPOLBCYP1A2CYP3A4 | |
| SCHEMBL4850390 | 1.00 | ALDH1A1 (0.40) | ALDH1A1HTTPOLBCYP1A2CYP3A4 | |
| SCHEMBL4852106 | 0.80 | NOTUM (0.46) | ALDH1A1HTTPOLBCYP1A2CYP3A4 | |
| SCHEMBL4852112 | 0.80 | NOTUM (0.46) | ALDH1A1HTTPOLBCYP1A2CYP3A4 | |
| SCHEMBL4857558 | 0.79 | SCN2B (0.44) | HTTCYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL4857564 | 0.79 | SCN2B (0.44) | HTTCYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL14269328 | 0.79 | CTSK (0.40) | ALDH1A1HTTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4852270 | 0.79 | CTSK (0.40) | ALDH1A1HTTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4857619 | 0.77 | FFAR1 (0.45) | ALDH1A1HTTPOLBCYP1A2CYP3A4 | |
| SCHEMBL4857610 | 0.77 | FFAR1 (0.45) | ALDH1A1HTTPOLBCYP1A2CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7329757-B2 | Substituted iminoazines | BAYER AKTIENGESELLSCHAFT (DE) | 2008-02-12 | — | — | US | disclosed |
| US-7329757-B2 | Substituted iminoazines | BAYER AKTIENGESELLSCHAFT (DE) | 2008-02-12 | — | — | US | disclosed |
| US-7186834-B2 | Substituted iminoazines | BAYER AKTIENGESELLSCHAFT (DE) | 2007-03-06 | — | — | US | disclosed |
| US-7186834-B2 | Substituted iminoazines | BAYER AKTIENGESELLSCHAFT (DE) | 2007-03-06 | — | — | US | disclosed |