Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 10/20 | 0.53 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.41 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19666792 | 0.80 | SMO (0.38) | KDM1ATSHR | |
| SCHEMBL17222691 | 0.71 | KDM1A (1.00) | KDM1ADPP4KCNH2 | |
| SCHEMBL24012951 | 0.70 | POLB (0.46) | MEN1CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL17222668 | 0.69 | POLB (0.40) | MEN1CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL19862684 | 0.66 | POLB (0.38) | MEN1CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL22193250 | 0.64 | MAPT (0.42) | HTR3EMEN1HTR3BCYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11313733 | 0.63 | MEN1 (0.59) | HTR3EMEN1HTR3BCYP1A2CYP2D6 | |
| SCHEMBL17230733 | 0.63 | POLB (0.35) | MEN1CYP1A2CYP2D6TSHRNFKB1 | |
| Hydrochloric Acid SCHEMBL3280602 | 0.62 | MEN1 (0.50) | KDM1AHTR3EMEN1HTR3BCYP1A2 | |
| SCHEMBL14336833 | 0.60 | CHRM2 (0.53) | HTR3EMEN1HTR3BCYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3137169-B1 | INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 | CELGENE QUANTICEL RES INC (US) | 2021-11-10 | — | — | EP | disclosed |
| WO-2018031658-A1 | TREATMENT OF RELAPSED AND/OR REFRACTORY SOLID TUMORS AND NON-HODGKIN'S LYMPHOMAS | CELGENE CORPORATION (US) | 2018-02-15 | — | — | WO | disclosed |