Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.44 |
| ▸ | TUBB | P07437 | 2/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.44 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.44 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.44 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.44 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.44 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.44 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.44 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.44 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.44 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.44 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22452446 | 0.92 | KDM4C (0.46) | CYP1A2CYP2C9CYP3A4HPGDCYP2C19 | |
| SCHEMBL22453406 | 0.90 | CYP1A2 (0.44) | CYP1A2CYP2C9TUBB4ATUBBTUBA3C | |
| SCHEMBL22453399 | 0.89 | TUBB4A (0.46) | CYP1A2CYP2C9TUBB4ATUBBTUBA3C | |
| SCHEMBL22453599 | 0.89 | TUBB4A (0.46) | CYP1A2CYP2C9TUBB4ATUBBTUBA3C | |
| SCHEMBL22452951 | 0.88 | TUBB4A (0.44) | CYP1A2CYP2C9TUBB4ATUBBTUBA3C | |
| SCHEMBL22453407 | 0.83 | TUBB4A (0.39) | CYP1A2CYP2C9TUBB4ATUBBTUBA3C | |
| SCHEMBL22453330 | 0.82 | KDM4C (0.47) | CYP1A2CYP2C9CYP3A4HPGDCYP2C19 | |
| SCHEMBL22453288 | 0.81 | MEN1 (0.57) | CYP1A2CYP2C9HPGDMEN1KMT2A | |
| SCHEMBL22452451 | 0.81 | AKR1C3 (0.48) | HPGDMEN1KMT2AKDM4CPOLB | |
| SCHEMBL22453050 | 0.81 | MEN1 (0.46) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |