Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4202881 | 0.82 | TSHR (0.39) | TSHRALDH1A1TAS1R3TAS1R1CYP3A4 | |
| SCHEMBL4202886 | 0.82 | TSHR (0.39) | TSHRALDH1A1TAS1R3TAS1R1CYP3A4 | |
| SCHEMBL4202878 | 0.82 | TSHR (0.39) | TSHRALDH1A1TAS1R3TAS1R1CYP3A4 | |
| SCHEMBL25762221 | 0.80 | TSHR (0.38) | TSHRALDH1A1TAS1R3TAS1R1CYP3A4 | |
| SCHEMBL10933616 | 0.78 | TSHR (0.37) | TSHRALDH1A1TAS1R3TAS1R1CYP3A4 | |
| SCHEMBL21698085 | 0.78 | CA2 (0.34) | TSHRALDH1A1MAPTTAS1R3TAS1R1 | |
| SCHEMBL1568040 | 0.78 | ALDH1A1 (0.34) | ALDH1A1MAPTCYP3A4TDP1LMNA | |
| SCHEMBL3920127 | 0.76 | — | — | |
| SCHEMBL16134038 | 0.76 | — | — | |
| SCHEMBL18294833 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020251953-A1 | STREPTOGRAMIN COMPOSITIONS AND THE USE THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2020-12-17 | — | — | WO | disclosed |