Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.63 |
| ▸ | LMNA | P02545 | 3/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | FAAH | O00519 | 3/20 | 0.51 |
| ▸ | MGLL | Q99685 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19468366 | 0.83 | ALDH1A1 (0.62) | ALDH1A1LMNAHPGDCYP1A2CYP2C9 | |
| SCHEMBL19468293 | 0.78 | ALDH1A1 (0.72) | ALDH1A1LMNAHPGDCYP1A2CYP2C9 | |
| SCHEMBL19494605 | 0.77 | PKM (0.45) | ALDH1A1LMNAHPGDMGLLPKM | |
| SCHEMBL19468028 | 0.77 | TAAR1 (0.54) | ALDH1A1LMNAHPGDMGLLHTT | |
| SCHEMBL1971387 | 0.77 | TSHR (0.54) | ALDH1A1LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19468385 | 0.77 | CYP1A2 (0.49) | ALDH1A1LMNAHPGDCYP1A2HTT | |
| SCHEMBL19468376 | 0.76 | RAB9A (0.47) | ALDH1A1LMNAHPGDMGLLHTT | |
| SCHEMBL19468181 | 0.76 | ALDH1A1 (0.47) | ALDH1A1LMNAHPGDMGLLHTT | |
| Hydrochloric Acid SCHEMBL11781054 | 0.75 | TSHR (0.51) | ALDH1A1LMNAHPGDCYP1A2CYP2D6 | |
| SCHEMBL148444 | 0.75 | MGLL (0.59) | ALDH1A1LMNAHPGDCYP1A2CYP2C9 |
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-3235815-A1 | AGENTS AGAINST PARASITIC HELMINTHS | PHILIPPS-UNIVERSITÄT MARBURG (DE) | 2017-10-25 | — | — | EP | disclosed |
| EP-3235815-A1 | AGENTS AGAINST PARASITIC HELMINTHS | PHILIPPS-UNIVERSITÄT MARBURG (DE) | 2017-10-25 | — | — | EP | disclosed |