Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 3/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.41 |
| ▸ | HTR3B | O95264 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.41 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | CDC7 | O00311 | 1/20 | 0.40 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | QPCT | Q16769 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18248929 | 0.84 | HTR3E (0.49) | SMN1; SMN2NPC1LMNAHTTRAB9A | |
| SCHEMBL21372715 | 0.84 | IDO1 (0.46) | IDO1CYP3A4CYP3A5CDC7DBF4 | |
| SCHEMBL21372902 | 0.84 | IDO1 (0.46) | IDO1LMNACYP3A4CYP3A5HTR3E | |
| SCHEMBL21372871 | 0.83 | IDO1 (0.47) | IDO1NPC1RAB9ACYP3A4BRD4 | |
| SCHEMBL21372968 | 0.81 | IDO1 (0.41) | IDO1SMN1; SMN2CYP3A4BRD4 | |
| SCHEMBL21372683 | 0.80 | IDO1 (0.46) | IDO1LMNAHTR3EHTR3BHTR3A | |
| SCHEMBL21373029 | 0.80 | IDO1 (0.39) | IDO1SMN1; SMN2LMNACYP3A4CYP3A5 | |
| SCHEMBL18224640 | 0.80 | CYP3A4 (0.52) | SMN1; SMN2NPC1LMNAHTTRAB9A | |
| SCHEMBL18224639 | 0.80 | CYP3A4 (0.52) | SMN1; SMN2NPC1LMNAHTTRAB9A | |
| SCHEMBL21373009 | 0.78 | HTT (0.40) | IDO1NPC1HTTRAB9ACYP3A4 |
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-3294732-B1 | BENZIMIDAZOLE AND IMADAZOPYRIDINE CARBOXIMIDAMIDE COMPOUNDS HAVING ACTIVITY AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE | GILEAD SCIENCES INC (US) | 2019-09-25 | — | — | EP | claimed |