Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29223026 | 0.81 | SIGMAR1 (0.34) | TAAR1SLC6A2ALDH1A1ALOX15KMT2A | |
| SCHEMBL2119818 | 0.78 | MEN1 (0.40) | TAAR1ALDH1A1ALOX15KMT2ACYP2C19 | |
| SCHEMBL45354 | 0.78 | MEN1 (0.40) | TAAR1ALDH1A1ALOX15KMT2ACYP2C19 | |
| SCHEMBL12721861 | 0.78 | MEN1 (0.40) | TAAR1ALDH1A1ALOX15KMT2ACYP2C19 | |
| SCHEMBL4265847 | 0.74 | MEN1 (0.38) | TAAR1ALDH1A1ALOX15KMT2ACYP2C19 | |
| SCHEMBL6057043 | 0.74 | ALDH1A1 (0.39) | TAAR1SLC6A2ALDH1A1ALOX15KMT2A | |
| SCHEMBL11428040 | 0.72 | KCNN4 (0.48) | TAAR1ALDH1A1ALOX15KMT2ACYP2C19 | |
| SCHEMBL8374359 | 0.72 | KCNN4 (0.48) | TAAR1ALDH1A1ALOX15KMT2ACYP2C19 | |
| SCHEMBL2038162 | 0.72 | KCNN4 (0.42) | TAAR1ALDH1A1ALOX15KMT2ACYP2C19 | |
| SCHEMBL8745890 | 0.72 | CYP3A4 (0.58) | TAAR1SLC6A2ALDH1A1ALOX15KMT2A |
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-5141968-A | POLYETHER POLYOLS BASED ON AROMATIC DIAMINES AND POLYAMINES, A PROCESS FOR THEIR PREPARATION, AND THEIR USE FOR POLYURETHANE AND POLYISOCYANURATE PLASTICS | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-25 | — | — | US | disclosed |