Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.42 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | PLG | P00747 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | PLAT | P00750 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11258241 | 0.92 | ALDH1A1 (0.41) | ALDH1A1HPGDTAS1R3TAS1R1TAS1R2 | |
| SCHEMBL11848097 | 0.86 | ALDH1A1 (0.43) | ALDH1A1HPGDTAS1R3TAS1R1TAS1R2 | |
| SCHEMBL11093189 | 0.83 | LMNA (0.37) | ALDH1A1LMNAPOLBDRD2HTR2A | |
| SCHEMBL11092487 | 0.83 | LMNA (0.37) | ALDH1A1MAPTLMNAPOLBDRD2 | |
| SCHEMBL11581841 | 0.83 | ALDH1A1 (0.35) | ALDH1A1MAPTLMNALCKF2 | |
| SCHEMBL11095766 | 0.81 | P2RX1 (0.39) | ALDH1A1MAPT | |
| SCHEMBL11251771 | 0.80 | ALDH1A1 (0.50) | ALDH1A1MAPTLMNAPOLBF2 | |
| SCHEMBL11097728 | 0.80 | CYP1A2 (0.36) | MAPTF2F10PLAUPLAT | |
| SCHEMBL11055179 | 0.80 | ALDH1A1 (0.48) | ALDH1A1HPGDTAS1R3TAS1R1TAS1R2 | |
| SCHEMBL11248653 | 0.80 | HTT (0.55) | ALDH1A1HPGDMAPTLMNAPOLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4326074-A | ANTIDIARRHEA AGENTS | WILLIAM H. RORER, INC. (US) | 1982-04-20 | — | — | US | disclosed |
| US-4115564-A | Treatment of diarrhea with amidinoureas | WILLIAM H. RORER, INC. (US) | 1978-09-19 | — | — | US | disclosed |
| US-4088785-A | HYPOTENSIVE AGENTS | WILLIAM H. RORER, INC. (US) | 1978-05-09 | — | — | US | disclosed |