Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | FABP3 | P05413 | 1/20 | 0.38 |
| ▸ | FABP4 | P15090 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31436624 | 0.81 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 | |
| SCHEMBL474121 | 0.78 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 | |
| SCHEMBL29977074 | 0.78 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 | |
| SCHEMBL2132960 | 0.78 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 | |
| Hydrochloric Acid SCHEMBL3758009 | 0.77 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 | |
| SCHEMBL29184110 | 0.75 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 | |
| SCHEMBL2339598 | 0.74 | TDP1 (0.38) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 | |
| SCHEMBL12479172 | 0.72 | KDM4E (0.49) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 | |
| SCHEMBL474007 | 0.71 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 | |
| SCHEMBL8686340 | 0.71 | SMN1; SMN2 (0.80) | ALDH1A1SMN1; SMN2MAPK1FABP3FABP4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117683034-A | Pyrrolo [1,2-B ] pyridazine derivatives | 吉利德科学公司 | 2024-03-12 | — | — | CN | disclosed |
| CN-112513044-B | Pyrrolo [1,2-B ] pyridazine derivatives | 吉利德科学公司 | 2023-11-07 | — | — | CN | disclosed |