Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL8782404 | 0.83 | NPC1 (0.51) | MEN1KMT2ADRD3NPC1MAPT | |
| SCHEMBL8782099 | 0.83 | HTR2A (0.44) | HTR2AHTR2CHTR2BDRD2HTR1A | |
| SCHEMBL8782066 | 0.81 | KMT2A (0.49) | HTR2AHTR2CHTR2BMEN1KMT2A | |
| SCHEMBL3888787 | 0.76 | KDM4E (0.53) | KDM4EMEN1KMT2ACYP3A4MAPT | |
| SCHEMBL9407110 | 0.76 | PBRM1 (0.37) | ESR1KDM4EMEN1KMT2AESR2 | |
| SCHEMBL8782123 | 0.75 | DRD2 (0.46) | ESR1MEN1KMT2AESR2DRD2 | |
| SCHEMBL28922579 | 0.74 | HTR2C (0.49) | HTR2AHTR2CHTR2BKDM4EKMT2A | |
| SCHEMBL15041795 | 0.73 | HTR2C (0.53) | HTR2AHTR2CHTR2BKMT2ACAPN1 | |
| SCHEMBL10855534 | 0.71 | CAPN1 (0.56) | HTR2AHTR2CHTR2BKDM4ECAPN1 | |
| SCHEMBL8498408 | 0.71 | CAPN1 (0.56) | HTR2AHTR2CHTR2BKDM4ECAPN1 |
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-0495610-B1 | Tetrahydroisoquinoline derivatives, processes for producing the same and fungicides containing the same | TOSOH CORP (JP) | 1997-06-18 | — | — | EP | disclosed |
| US-5401752-A | EFFECTIVE AGAINST DRUG RESISTANT FUNGI | TOSOH CORPORATION (JP) | 1995-03-28 | — | — | US | disclosed |
| EP-0495610-A1 | Tetrahydroisoquinoline derivatives, processes for producing the same and fungicides containing the same | TOSOH CORPORATION (JP) | 1992-07-22 | — | — | EP | disclosed |