Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.35 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.35 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.35 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.35 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.35 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.35 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.35 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.35 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.35 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.35 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8910750 | 0.85 | SLC9A1 (0.35) | CYP1A2ALDH1A1SMN1; SMN2TUBB4ATUBB | |
| SCHEMBL8909672 | 0.83 | TUBB4A (0.33) | CYP1A2ALDH1A1SMN1; SMN2NPSR1TUBB4A | |
| SCHEMBL196831 | 0.74 | HSD17B1 (0.36) | ALDH1A1HPGDSMN1; SMN2HTR6PRMT5 | |
| SCHEMBL16289810 | 0.74 | CYP1A2 (0.55) | CYP1A2ALDH1A1HPGDHSD17B10CYP2A6 | |
| SCHEMBL15031501 | 0.72 | CYP1A2 (0.53) | CYP1A2ALDH1A1HPGDHSD17B10CYP2A6 | |
| SCHEMBL7037608 | 0.72 | CASP6 (0.59) | CYP1A2ALDH1A1HPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL2513029 | 0.72 | ALDH1A1 (0.46) | CYP1A2ALDH1A1SMN1; SMN2GAACYP3A4 | |
| SCHEMBL197879 | 0.72 | MEN1 (0.44) | ALDH1A1HTR6 | |
| SCHEMBL3562296 | 0.72 | ATM (0.39) | HTR6 | |
| SCHEMBL12829693 | 0.71 | CYP1A2 (0.41) | CYP1A2ALDH1A1HPGDHSD17B10SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5596095-A | REMOVAL OF NEOPENTYL PROTECTING GROUPS AND REGENERATION OF PARENT DRUGS | PROCEPT, INC. (US) | 1997-01-21 | — | — | US | disclosed |
| WO-1996018609-A1 | FORMATION AND UTILITY OF SULFONIC ACID PROTECTING GROUPS | PROCEPT, INC. (US) | 1996-06-20 | — | — | WO | disclosed |