Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | TP53 | P04637 | 2/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 5/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | APEX1 | P27695 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1200586 | 0.91 | SMN1; SMN2 (0.71) | SMN1; SMN2ALDH1A1RAB9ALMNATP53 | |
| SCHEMBL10697569 | 0.82 | SMN1; SMN2 (0.51) | SMN1; SMN2ALDH1A1RAB9ALMNATP53 | |
| SCHEMBL17417665 | 0.81 | SMN1; SMN2 (0.62) | SMN1; SMN2ALDH1A1RAB9ALMNATP53 | |
| SCHEMBL9319436 | 0.80 | GABRA1 (0.60) | SMN1; SMN2ALDH1A1RAB9ALMNATP53 | |
| SCHEMBL1075376 | 0.77 | ALDH1A1 (0.61) | SMN1; SMN2ALDH1A1RAB9ALMNATP53 | |
| SCHEMBL12611037 | 0.76 | RAB9A (0.66) | SMN1; SMN2ALDH1A1RAB9ALMNATP53 | |
| SCHEMBL9319718 | 0.76 | KDM4E (0.59) | SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2 | |
| SCHEMBL2978428 | 0.74 | KDM4E (0.67) | SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2 | |
| SCHEMBL2807362 | 0.73 | KDM4E (0.56) | SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2 | |
| SCHEMBL29415457 | 0.73 | KDM4E (0.56) | SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5371220-A | Bicyclo-heterocyclic intermediates for cephalosporin compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-12-06 | — | — | US | disclosed |
| US-5232918-A | Bactericides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-08-03 | — | — | US | disclosed |
| US-4439436-A | BACTERICIDES | STERLING DRUG INC. (US) | 1984-03-27 | — | — | US | disclosed |
| US-4086236-A | ANTIBACTERIAL | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1978-04-25 | — | — | US | disclosed |
| US-4036962-A | BACTERICIDES | E. I. DU PONT DE NEMOURS AND CO. (US) | 1977-07-19 | — | — | US | disclosed |