Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.42 |
| ▸ | TAS1R2 | Q8TE23 | 3/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 2/20 | 0.32 |
| ▸ | MMP2 | P08253 | 2/20 | 0.32 |
| ▸ | MMP3 | P08254 | 2/20 | 0.32 |
| ▸ | MMP9 | P14780 | 2/20 | 0.32 |
| ▸ | MMP8 | P22894 | 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 | |
|---|---|---|---|---|
| SCHEMBL23565702 | 0.79 | CYP3A4 (0.41) | CYP3A4CYP2C9CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL24153230 | 0.79 | MEN1 (0.36) | CYP3A4CYP2C9CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL31483043 | 0.77 | CYP2C9 (0.46) | CYP3A4CYP2C9CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL18678083 | 0.77 | ALDH1A1 (0.40) | CYP2C9TAS1R3TAS1R1TAS1R2MEN1 | |
| SCHEMBL16298847 | 0.77 | CYP2C9 (0.46) | CYP3A4CYP2C9CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL8243268 | 0.77 | — | — | |
| SCHEMBL1018455 | 0.76 | CYP3A4 (0.44) | CYP3A4CYP2C9CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL8433156 | 0.76 | CYP3A4 (0.44) | CYP3A4CYP2C9CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL13826479 | 0.76 | CYP3A4 (0.44) | CYP3A4CYP2C9CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL1018454 | 0.76 | CYP3A4 (0.44) | CYP3A4CYP2C9CYP2C19TAS1R3TAS1R1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3892305-A1 | HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY | Sutro Biopharma, Inc. (US) | 2021-10-13 | — | — | EP | disclosed |
| EP-3250237-B1 | HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY | SUTRO BIOPHARMA INC (US) | 2021-05-26 | — | — | EP | disclosed |
| EP-1883627-B1 | BIR DOMAIN BINDING COMPOUNDS | PHARMASCIENCE INC (CA) | 2018-04-18 | — | — | EP | disclosed |