Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 5/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | FPR2 | P25090 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9151600 | 0.82 | ACACB (0.45) | ACACBTAS1R3TAS1R1FPR2SLC6A4 | |
| SCHEMBL9152037 | 0.82 | ACACB (0.45) | ACACBTAS1R3TAS1R1FPR2SLC6A4 | |
| SCHEMBL9287683 | 0.81 | ACACB (0.44) | ACACBTAS1R3TAS1R1SLC6A4ALDH1A1 | |
| SCHEMBL9151710 | 0.77 | ACACB (0.51) | ACACBTAS1R3TAS1R1FPR2MMP2 | |
| SCHEMBL9152403 | 0.70 | ACACB (0.47) | ACACBTAS1R3TAS1R1FPR2SLC6A4 | |
| SCHEMBL9151052 | 0.69 | SLC6A4 (0.53) | TAS1R3TAS1R1SLC6A4 | |
| SCHEMBL9493972 | 0.68 | SRC (0.54) | ACACBFPR2MMP2MMP9AKR1C3 | |
| SCHEMBL9287266 | 0.68 | ACACB (0.47) | ACACBTAS1R3TAS1R1AKR1C3AKR1C2 | |
| SCHEMBL9405607 | 0.68 | SMN1; SMN2 (0.35) | MEN1LMNAMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL11552778 | 0.67 | MTNR1A (0.54) | ACACBTAS1R3TAS1R1FPR2ALDH1A1 |
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-5284966-A | Intermediates for the stereochemical inversion of (2S,3S)-2-amino-3-phenyl-1,3-propanediols into their (2R,3R) enantiomers | ZAMBON GROUP S.P.A. (IT) | 1994-02-08 | — | — | US | disclosed |