Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL9130840 | 1.00 | ALDH1A1 (0.49) | ALDH1A1RAB9AHPGDNPC1TP53 | |
| SCHEMBL9132837 | 0.99 | ALDH1A1 (0.50) | ALDH1A1RAB9AHPGDNPC1TP53 | |
| Hydrochloric Acid SCHEMBL9129366 | 0.98 | ALDH1A1 (0.49) | ALDH1A1RAB9AHPGDNPC1TP53 | |
| SCHEMBL9128690 | 0.94 | HPGD (0.44) | ALDH1A1RAB9AHPGDNPC1TP53 | |
| SCHEMBL18608547 | 0.90 | CNR2 (0.47) | RAB9ANPC1CNR2CNR1 | |
| SCHEMBL18608414 | 0.89 | TGFBR1 (0.44) | ALDH1A1HPGDSMN1; SMN2CNR2 | |
| SCHEMBL18608648 | 0.86 | LIPG (0.50) | ALDH1A1HPGD | |
| SCHEMBL18608345 | 0.83 | CNR2 (0.42) | CNR2CNR1 | |
| SCHEMBL18608560 | 0.83 | MTNR1A (0.47) | ALDH1A1RAB9AHPGDNPC1TP53 | |
| SCHEMBL9388608 | 0.81 | EPHX1 (0.45) | ALDH1A1RAB9A |
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-5387588-A | Antiulcer agents | CHINOIN GYOGYSZER- ES VEGYESZETI TERMEKEK GYARA RT. (HU) | 1995-02-07 | — | — | US | disclosed |
| US-5252572-A | Antiulcer agent | CHINOIN GYOGYSZER- ES VEGYESZETI TERMEKEK GYARA RT. (HU) | 1993-10-12 | — | — | US | disclosed |
| US-5158951-A | Pyridopyrimidine derivatives useful in treatment of ulcers | CHINOIN GYOGYSZER- ES VEGYESZETI TERMEKEK GYAR RT. (HU) | 1992-10-27 | — | — | US | disclosed |