Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.61 |
| ▸ | HTR2C | P28335 | 3/20 | 0.61 |
| ▸ | HTR1A | P08908 | 2/20 | 0.61 |
| ▸ | HTR1D | P28221 | 2/20 | 0.61 |
| ▸ | HTR6 | P50406 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | HTR1B | P28222 | 1/20 | 0.61 |
| ▸ | HTR7 | P34969 | 1/20 | 0.61 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.61 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.61 |
| ▸ | HTR2B | P41595 | 3/20 | 0.60 |
| ▸ | BLM | P54132 | 1/20 | 0.59 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.55 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.54 |
| ▸ | TUBB | P07437 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL10679569 | 0.80 | GPR84 (0.52) | HTR2AHTR2CHTR1AHTR1DHTR6 | |
| SCHEMBL4481268 | 0.79 | KDM4E (0.65) | HTR1ACYP1A2MAPTHTR2BBLM | |
| SCHEMBL4493312 | 0.78 | KDM4E (0.56) | HTR1ACYP1A2MAPTHTR2BBLM | |
| SCHEMBL9516163 | 0.77 | HTR2A (0.58) | HTR2AHTR2CHTR1AHTR1DHTR6 | |
| SCHEMBL1399200 | 0.77 | HTR1A (0.64) | HTR2AHTR2CHTR1AHTR1DHTR6 | |
| 5-Methoxytryptamine SCHEMBL29390103 | 0.76 | HTR1A (1.00) | HTR2AHTR2CHTR1AHTR1DHTR6 | |
| SCHEMBL31397695 | 0.76 | IDO1 (0.79) | CYP1A2HTR2BGPR84TUBB4ATUBB | |
| 5-Methoxytryptamine SCHEMBL41982 | 0.76 | HTR1A (1.00) | HTR2AHTR2CHTR1AHTR1DHTR6 | |
| SCHEMBL3976318 | 0.75 | HTR2B (1.00) | HTR2AHTR2CHTR1AHTR1DHTR6 | |
| SCHEMBL4481973 | 0.75 | ALDH1A1 (0.54) | CYP1A2MAPTNPSR1GPR84TUBB4A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5227488-A | AZA SPIRO DECANE AND USE THEREOF IN TREATING CNS DISORDERS | NOVO NORDISK A/S (DK) | 1993-07-13 | — | — | US | disclosed |
| EP-0495826-A1 | INDOLE DERIVATIVES, THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1992-07-29 | — | — | EP | disclosed |
| WO-1991004973-A1 | INDOLE DERIVATIVES, THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1991-04-18 | — | — | WO | disclosed |
| US-4725604-A | ADMINISTERING 2-(SUBSTITUTED-ETHYLTHIO) INDOLES OR BENZOTHIOPHENES | MCNEILAB, INC. (US) | 1988-02-16 | — | — | US | disclosed |
| US-4584302-A | ADMINISTERING INDOLE AND BENZOTHIPOPHENE COMPOUNDS HAVING PENDANT PYRROLIDINYLIDENE AMINO OR PIPERIDINYIDENEAMINO GROUPS | MCNEILAB, INC. (US) | 1986-04-22 | — | — | US | disclosed |