Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 4/20 | 0.67 |
| ▸ | HTR1B | P28222 | 2/20 | 0.67 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | RXRB | P28702 | 3/20 | 0.41 |
| ▸ | RXRA | P19793 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2687552 | 0.82 | HTR1D (0.58) | HTR1DHTR1BPOLBRXRBRXRA | |
| SCHEMBL777612 | 0.81 | HTT (0.45) | HTR1DHTR1BPOLBHTTALDH1A1 | |
| SCHEMBL8149583 | 0.80 | HTR1D (1.00) | HTR1DHTR1BPOLBRXRBRXRA | |
| SCHEMBL21049510 | 0.78 | HTT (0.42) | HTR1DHTR1BPOLBHTTALDH1A1 | |
| SCHEMBL11470582 | 0.75 | CYP2C19 (0.47) | HTR1DHTR1BPOLBHTTALDH1A1 | |
| SCHEMBL8712162 | 0.74 | HTT (0.40) | HTR1DHTR1BHTTADRA2AADRA2B | |
| SCHEMBL15088033 | 0.74 | HTR1D (0.59) | HTR1DHTR1BPOLBRXRBRXRA | |
| SCHEMBL3297389 | 0.74 | HTR1D (0.50) | HTR1DHTR1BPOLBRXRBRXRA | |
| Hydrochloric Acid SCHEMBL7983275 | 0.73 | HTT (0.39) | HTR1DHTR1BHTTADRA2AADRA2B | |
| SCHEMBL22014434 | 0.73 | AGBL2 (0.40) | HTR1DHTR1BRXRBRXRAHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-6048862-A | Benzylamidine derivatives with serotonin receptor binding activity | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 2000-04-11 | — | — | US | disclosed |
| US-5969137-A | TREATMENT OF NERVOUS SYSTEM DISORDERS | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1999-10-19 | — | — | US | disclosed |