Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23167454 | 1.00 | TDP1 (0.51) | TDP1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL23167452 | 1.00 | TDP1 (0.51) | TDP1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL23167159 | 0.85 | ALDH1A1 (0.44) | TDP1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29772015 | 0.85 | ALDH1A1 (0.44) | TDP1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL23167160 | 0.85 | ALDH1A1 (0.44) | TDP1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL23208395 | 0.82 | TSHR (0.65) | TDP1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL18728097 | 0.79 | MRGPRX4 (0.41) | TDP1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL18728096 | 0.79 | MRGPRX4 (0.41) | TDP1TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL18728937 | 0.78 | KMT2A (0.54) | TDP1CYP1A2TSHRCYP2C19KMT2A | |
| SCHEMBL18729035 | 0.78 | CYP1A2 (0.43) | TDP1TP53CYP1A2CYP3A4CYP2D6 |
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-4037776-A1 | COMPOUNDS USEFUL AS IMMUNOMODULATORS | Bristol-Myers Squibb Company (US) | 2022-08-10 | — | — | EP | disclosed |
| CN-114761085-A | Compounds useful as immunomodulators | 百时美施贵宝公司 | 2022-07-15 | — | — | CN | disclosed |