Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 7/20 | 0.46 |
| ▸ | HTR1A | P08908 | 3/20 | 0.46 |
| ▸ | NR2E1 | Q9Y466 | 5/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.42 |
| ▸ | HTR2B | P41595 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | HTR6 | P50406 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | SCN1A | P35498 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6239357 | 0.81 | HTR1A (0.70) | HTR1BHTR1ACYP2D6CYP1A2ADRB2 | |
| SCHEMBL6239353 | 0.81 | HTR1A (0.70) | HTR1BHTR1ACYP2D6CYP1A2ADRB2 | |
| SCHEMBL10407544 | 0.79 | KDM4E (0.56) | HTTCYP2D6CYP1A2ADRB2ADRB1 | |
| SCHEMBL29802707 | 0.76 | HTT (0.53) | HTR1BNR2E1HTTHTR1DSIGMAR1 | |
| SCHEMBL294796 | 0.75 | MCHR1 (0.52) | HTR1BNR2E1HTTHTR1DCYP1A2 | |
| SCHEMBL294795 | 0.75 | MCHR1 (0.46) | HTR1BHTR1ANR2E1HTTHTR1D | |
| SCHEMBL28717946 | 0.74 | HTR1B (0.61) | HTR1BNR2E1HTR1DCYP1A2SLC6A4 | |
| SCHEMBL8344968 | 0.74 | HTR1B (0.64) | HTR1BNR2E1HTR1DSLC6A4ALDH1A1 | |
| SCHEMBL11273967 | 0.73 | CYP2D6 (0.63) | HTR1BHTR1ANR2E1HTR1DCYP2D6 | |
| SCHEMBL27265895 | 0.73 | HTR1B (0.62) | HTR1BNR2E1HTR1DSLC6A4ALDH1A1 |
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-5104959-A | POLYURETHANE-BASED REACTIVE ADHESIVES IN WHICH THE ISOCYANATE IS STABILIZED BY A POLYETHER AMINE | BAYER AKTIENGESELLSCHAFT (DE) | 1992-04-14 | — | — | US | disclosed |