Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.57 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.53 |
| ▸ | TUBB | P07437 | 1/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.53 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.53 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.53 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.53 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.53 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.53 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.53 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.53 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.53 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.53 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.53 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.53 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.53 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.52 |
| ▸ | MAOB | P27338 | 2/20 | 0.52 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.50 |
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL27496419 | 0.98 | TAAR1 (0.55) | TAAR1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL6568496 | 0.92 | CALM1 (0.63) | TAAR1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL6570685 | 0.92 | CALM1 (0.58) | TAAR1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL542479 | 0.87 | LTA4H (0.63) | TAAR1IDO1CA12CA1CA2 | |
| SCHEMBL834551 | 0.86 | TAAR1 (0.73) | TAAR1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL28376353 | 0.84 | KCNH2 (0.46) | TAAR1CALM1MAOBALDH1A1RAB9A | |
| SCHEMBL28257690 | 0.83 | TAAR1 (0.44) | TAAR1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL6736555 | 0.83 | IDO1 (0.53) | TAAR1CALM1MAOBIDO1CA12 | |
| SCHEMBL833408 | 0.83 | KCNH2 (0.49) | TAAR1CALM1MAOBAOC3SIGMAR1 | |
| SCHEMBL28857985 | 0.82 | CHRM2 (0.58) | KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019238067-A1 | PYRROLO [2, 3-B] PYRIDINES OR PYRROLO [2, 3-B] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2019-12-19 | — | — | WO | disclosed |
| EP-0407955-A1 | New hetrazepines acting as PAF antagonists, process for their production and their use as drugs | BOEHRINGER INGELHEIM KG (DE) | 1991-01-16 | — | — | EP | disclosed |