Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.32 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 2/20 | 0.31 |
| ▸ | F10 | P00742 | 2/20 | 0.31 |
| ▸ | PLG | P00747 | 2/20 | 0.31 |
| ▸ | PLAU | P00749 | 2/20 | 0.31 |
| ▸ | PLAT | P00750 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11253091 | 0.82 | ALDH1A1 (0.40) | ALDH1A1POLBDRD2HTR2AHTR2B | |
| SCHEMBL11579586 | 0.82 | DRD2 (0.44) | ALDH1A1POLBDRD2HTR2AHTR2B | |
| SCHEMBL11259523 | 0.82 | ALDH1A1 (0.38) | ALDH1A1POLBDRD2HTR2AHTR2B | |
| SCHEMBL11251439 | 0.81 | HTT (0.42) | ALDH1A1LMNAHTTNPC1RAB9A | |
| SCHEMBL6692615 | 0.79 | DRD2 (0.54) | ALDH1A1POLBDRD2HTR2AHTR2B | |
| Hydrochloric Acid SCHEMBL11258555 | 0.78 | PKM (0.55) | ALDH1A1POLBDRD2HTR2AHTR2B | |
| SCHEMBL11093189 | 0.76 | LMNA (0.37) | ALDH1A1POLBDRD2HTR2AHTR2B | |
| SCHEMBL11264201 | 0.76 | LMNA (0.41) | ALDH1A1PKMLMNAHTTF2 | |
| SCHEMBL11249510 | 0.76 | SMN1; SMN2 (0.51) | ALDH1A1POLBNPC1RAB9AKMT2A | |
| SCHEMBL4098970 | 0.76 | KMT2A (0.46) | ALDH1A1HTTHDAC1KMT2A |
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-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 |