Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 6/20 | 0.48 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8194559 | 0.98 | IDO1 (0.46) | IDO1FOLH1TSHRAPPRAPGEF4 | |
| SCHEMBL18905641 | 0.84 | TSHR (0.48) | TSHRAPPRAPGEF4HTR6ROCK2 | |
| SCHEMBL3617649 | 0.80 | RAPGEF4 (0.55) | TSHRRAPGEF4MAPTGRIN2DGRIN3B | |
| SCHEMBL3150743 | 0.78 | PDK1 (0.49) | TSHRAPPMAPT | |
| SCHEMBL10061632 | 0.78 | KDM4E (0.52) | TSHRAPPMAPTCYP3A4 | |
| SCHEMBL12642059 | 0.78 | TSHR (0.42) | TSHRAPPRAPGEF4HTR6ROCK2 | |
| SCHEMBL7047409 | 0.78 | TSHR (0.42) | TSHRAPPRAPGEF4HTR6ROCK2 | |
| Hydrochloric Acid SCHEMBL2868312 | 0.78 | RAPGEF4 (0.53) | RAPGEF4MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL12707605 | 0.78 | TSHR (0.54) | TSHRAPPHTR6TAAR1MAPT | |
| SCHEMBL2291506 | 0.78 | HTR6 (0.50) | TSHRAPPHTR6CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3521314-A1 | NEW ANTIBODY-DRUG CONJUGATES AND USE THEREOF IN TREATMENT | Université François Rabelais (FR) | 2019-08-07 | — | — | EP | disclosed |